N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide

C171H235N21O10 — CID 158126018

IUPACN-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide
SMILESCCCCCn1c2ccccc2c2cc(C(=O)NCC3CCCCC3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)C3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CCC(C)(C)C)CC3)ccc21.CCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21.CCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21
InChIInChI=1S/C30H42N4O2.C30H43N3O.2C29H40N4O2.C28H38N4O2.C25H32N2O/c1-5-6-9-16-34-26-11-8-7-10-24(26)25-19-23(12-13-27(25)34)29(36)31-20-22-14-17-33(18-15-22)21-28(35)32-30(2,3)4;1-5-6-9-17-33-27-11-8-7-10-25(27)26-21-24(12-13-28(26)33)29(34)31-22-23-14-18-32(19-15-23)20-16-30(2,3)4;1-5-6-15-33-25-10-8-7-9-23(25)24-18-22(11-12-26(24)33)28(35)30-19-21-13-16-32(17-14-21)20-27(34)31-29(2,3)4;1-5-6-9-15-33-25-11-8-7-10-23(25)24-17-22(12-13-26(24)33)28(35)30-18-21-14-16-32(19-21)20-27(34)31-29(2,3)4;1-5-14-32-24-9-7-6-8-22(24)23-17-21(10-11-25(23)32)27(34)29-18-20-12-15-31(16-13-20)19-26(33)30-28(2,3)4;1-2-3-9-16-27-23-13-8-7-12-21(23)22-17-20(14-15-24(22)27)25(28)26-18-19-10-5-4-6-11-19/h7-8,10-13,19,22H,5-6,9,14-18,20-21H2,1-4H3,(H,31,36)(H,32,35);7-8,10-13,21,23H,5-6,9,14-20,22H2,1-4H3,(H,31,34);7-12,18,21H,5-6,13-17,19-20H2,1-4H3,(H,30,35)(H,31,34);7-8,10-13,17,21H,5-6,9,14-16,18-20H2,1-4H3,(H,30,35)(H,31,34);6-11,17,20H,5,12-16,18-19H2,1-4H3,(H,29,34)(H,30,33);7-8,12-15,17,19H,2-6,9-11,16,18H2,1H3,(H,26,28)
InChIKeyFSEKJOQZMNLKEN-UHFFFAOYSA-N
MW2744.90 g/mol
LogP32.96
Rot. Bonds49

About N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide

N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide (PubChem CID 158126018) has the molecular formula C171H235N21O10 and a molecular weight of 2744.90 g/mol. Its IUPAC name is N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide.

Molecular Properties

Compound NameN-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide
PubChem CID158126018
Molecular FormulaC171H235N21O10
Molecular Weight2744.90 g/mol
Exact Mass2742.85
IUPAC NameN-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide
SMILESCCCCCn1c2ccccc2c2cc(C(=O)NCC3CCCCC3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)C3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CCC(C)(C)C)CC3)ccc21.CCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21.CCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21
InChIInChI=1S/C30H42N4O2.C30H43N3O.2C29H40N4O2.C28H38N4O2.C25H32N2O/c1-5-6-9-16-34-26-11-8-7-10-24(26)25-19-23(12-13-27(25)34)29(36)31-20-22-14-17-33(18-15-22)21-28(35)32-30(2,3)4;1-5-6-9-17-33-27-11-8-7-10-25(27)26-21-24(12-13-28(26)33)29(34)31-22-23-14-18-32(19-15-23)20-16-30(2,3)4;1-5-6-15-33-25-10-8-7-9-23(25)24-18-22(11-12-26(24)33)28(35)30-19-21-13-16-32(17-14-21)20-27(34)31-29(2,3)4;1-5-6-9-15-33-25-11-8-7-10-23(25)24-17-22(12-13-26(24)33)28(35)30-18-21-14-16-32(19-21)20-27(34)31-29(2,3)4;1-5-14-32-24-9-7-6-8-22(24)23-17-21(10-11-25(23)32)27(34)29-18-20-12-15-31(16-13-20)19-26(33)30-28(2,3)4;1-2-3-9-16-27-23-13-8-7-12-21(23)22-17-20(14-15-24(22)27)25(28)26-18-19-10-5-4-6-11-19/h7-8,10-13,19,22H,5-6,9,14-18,20-21H2,1-4H3,(H,31,36)(H,32,35);7-8,10-13,21,23H,5-6,9,14-20,22H2,1-4H3,(H,31,34);7-12,18,21H,5-6,13-17,19-20H2,1-4H3,(H,30,35)(H,31,34);7-8,10-13,17,21H,5-6,9,14-16,18-20H2,1-4H3,(H,30,35)(H,31,34);6-11,17,20H,5,12-16,18-19H2,1-4H3,(H,29,34)(H,30,33);7-8,12-15,17,19H,2-6,9-11,16,18H2,1H3,(H,26,28)
InChIKeyFSEKJOQZMNLKEN-UHFFFAOYSA-N
XLogP32.96
TPSA336.78 Ų
H-Bond Donors10
H-Bond Acceptors21
Rotatable Bonds49
Heavy Atoms202
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002744.90
LogP ≤ 532.96
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide?
The IUPAC name of N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide (CID 158126018) is N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide.
What is the SMILES notation for N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide?
The canonical SMILES for N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide is CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCCCC3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)C3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21.CCCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CCC(C)(C)C)CC3)ccc21.CCCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21.CCCn1c2ccccc2c2cc(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21.
What is the InChIKey of N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide?
The InChIKey is FSEKJOQZMNLKEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H42N4O2.C30H43N3O.2C29H40N4O2.C28H38N4O2.C25H32N2O/c1-5-6-9-16-34-26-11-8-7-10-24(26)25-19-23(12-13-27(25)34)29(36)31-20-22-14-17-33(18-15-22)21-28(35)32-30(2,3)4;1-5-6-9-17-33-27-11-8-7-10-25(27)26-21-24(12-13-28(26)33)29(34)31-22-23-14-18-32(19-15-23)20-16-30(2,3)4;1-5-6-15-33-25-10-8-7-9-23(25)24-18-22(11-12-26(24)33)28(35)30-19-21-13-16-32(17-14-21)20-27(34)31-29(2,3)4;1-5-6-9-15-33-25-11-8-7-10-23(25)24-17-22(12-13-26(24)33)28(35)30-18-21-14-16-32(19-21)20-27(34)31-29(2,3)4;1-5-14-32-24-9-7-6-8-22(24)23-17-21(10-11-25(23)32)27(34)29-18-20-12-15-31(16-13-20)19-26(33)30-28(2,3)4;1-2-3-9-16-27-23-13-8-7-12-21(23)22-17-20(14-15-24(22)27)25(28)26-18-19-10-5-4-6-11-19/h7-8,10-13,19,22H,5-6,9,14-18,20-21H2,1-4H3,(H,31,36)(H,32,35);7-8,10-13,21,23H,5-6,9,14-20,22H2,1-4H3,(H,31,34);7-12,18,21H,5-6,13-17,19-20H2,1-4H3,(H,30,35)(H,31,34);7-8,10-13,17,21H,5-6,9,14-16,18-20H2,1-4H3,(H,30,35)(H,31,34);6-11,17,20H,5,12-16,18-19H2,1-4H3,(H,29,34)(H,30,33);7-8,12-15,17,19H,2-6,9-11,16,18H2,1H3,(H,26,28).
What are the key properties of N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide?
N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide has a molecular weight of 2744.90 g/mol, XLogP of 32.96, 49 rotatable bonds, 10 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-9-propylcarbazole-3-carboxamide;N-[[1-[2-(tert-butylamino)-2-oxoethyl]pyrrolidin-3-yl]methyl]-9-pentylcarbazole-3-carboxamide;9-butyl-N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]carbazole-3-carboxamide;N-(cyclohexylmethyl)-9-pentylcarbazole-3-carboxamide;N-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]-9-pentylcarbazole-3-carboxamide is sourced from PubChem (CID 158126018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).