8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

C22H31N3O — CID 67634743

IUPAC8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
SMILESCCCC1Cc2c([nH]c3ccc(C(=O)NC4CCCCC4)cc23)C(N)C1
InChIInChI=1S/C22H31N3O/c1-2-6-14-11-18-17-13-15(22(26)24-16-7-4-3-5-8-16)9-10-20(17)25-21(18)19(23)12-14/h9-10,13-14,16,19,25H,2-8,11-12,23H2,1H3,(H,24,26)
InChIKeyTVAOEZLZJIOTTP-UHFFFAOYSA-N
MW353.51 g/mol
LogP4.59
Rot. Bonds4

About 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide (PubChem CID 67634743) has the molecular formula C22H31N3O and a molecular weight of 353.51 g/mol. Its IUPAC name is 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide.

Molecular Properties

Compound Name8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
PubChem CID67634743
Molecular FormulaC22H31N3O
Molecular Weight353.51 g/mol
Exact Mass353.25
IUPAC Name8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
SMILESCCCC1Cc2c([nH]c3ccc(C(=O)NC4CCCCC4)cc23)C(N)C1
InChIInChI=1S/C22H31N3O/c1-2-6-14-11-18-17-13-15(22(26)24-16-7-4-3-5-8-16)9-10-20(17)25-21(18)19(23)12-14/h9-10,13-14,16,19,25H,2-8,11-12,23H2,1H3,(H,24,26)
InChIKeyTVAOEZLZJIOTTP-UHFFFAOYSA-N
XLogP4.59
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.51
LogP ≤ 54.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

8-amino-6-propyl-6,7,8,9-tetrahydro-5H-carbazol-3-ol
CID 67638542
9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide
CID 67634741
N-(8-amino-6-ethyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)-4-iodobenzamide
CID 67628262
N-cycloheptyl-2-(3,4-dimethoxyphenyl)-3-ethyl-1H-indole-5-carboxamide
CID 150682988
1-N,3-N,5-N-tris(4-propylcyclohexyl)benzene-1,3,5-tricarboxamide
CID 67413322
N-cyclohexyl-3,4-diethoxybenzamide
CID 917356
N-cycloheptyl-4-(ethylamino)-3-methylbenzamide
CID 63210563
[8-amino-6-(ethylamino)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]-(4-nitrophenyl)methanone
CID 67626637
3-bromo-N-cyclohexyl-4-propoxybenzamide
CID 17342733
2-amino-N-(4-propylcyclohexyl)pyridine-4-carboxamide
CID 55042146
4-[(4-propylcyclohexyl)carbamoyl]benzoic acid
CID 61409748
4-amino-N-cyclohexyl-3-methylbenzamide
CID 16773559

Frequently Asked Questions

What is the IUPAC name of 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The IUPAC name of 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide (CID 67634743) is 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide.
What is the SMILES notation for 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The canonical SMILES for 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide is CCCC1Cc2c([nH]c3ccc(C(=O)NC4CCCCC4)cc23)C(N)C1.
What is the InChIKey of 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The InChIKey is TVAOEZLZJIOTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31N3O/c1-2-6-14-11-18-17-13-15(22(26)24-16-7-4-3-5-8-16)9-10-20(17)25-21(18)19(23)12-14/h9-10,13-14,16,19,25H,2-8,11-12,23H2,1H3,(H,24,26).
What are the key properties of 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide has a molecular weight of 353.51 g/mol, XLogP of 4.59, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide is sourced from PubChem (CID 67634743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).