9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide

C22H31N3O — CID 67634741

IUPAC9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide
SMILESCCCC1CCc2c(c3cc(C(=O)NC4CCCCC4)ccc3n2N)C1
InChIInChI=1S/C22H31N3O/c1-2-6-15-9-11-20-18(13-15)19-14-16(10-12-21(19)25(20)23)22(26)24-17-7-4-3-5-8-17/h10,12,14-15,17H,2-9,11,13,23H2,1H3,(H,24,26)
InChIKeyITAKSCWIMJSHFF-UHFFFAOYSA-N
MW353.51 g/mol
LogP4.32
Rot. Bonds4

About 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide

9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide (PubChem CID 67634741) has the molecular formula C22H31N3O and a molecular weight of 353.51 g/mol. Its IUPAC name is 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide.

Molecular Properties

Compound Name9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide
PubChem CID67634741
Molecular FormulaC22H31N3O
Molecular Weight353.51 g/mol
Exact Mass353.25
IUPAC Name9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide
SMILESCCCC1CCc2c(c3cc(C(=O)NC4CCCCC4)ccc3n2N)C1
InChIInChI=1S/C22H31N3O/c1-2-6-15-9-11-20-18(13-15)19-14-16(10-12-21(19)25(20)23)22(26)24-17-7-4-3-5-8-17/h10,12,14-15,17H,2-9,11,13,23H2,1H3,(H,24,26)
InChIKeyITAKSCWIMJSHFF-UHFFFAOYSA-N
XLogP4.32
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.51
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-amino-N-cyclohexyl-6-propyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 67634743
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
3-bromo-N-cyclohexyl-4-propoxybenzamide
CID 17342733
2-amino-N-(4-propylcyclohexyl)pyridine-4-carboxamide
CID 55042146
4-amino-N-cyclohexyl-3-methylbenzamide
CID 16773559
4-[(4-propylcyclohexyl)carbamoyl]benzoic acid
CID 61409748
N-cyclohexyl-1-propanoyl-2,3-dihydroindole-6-carboxamide
CID 53014606
4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide
CID 109042876
3-amino-N-cyclohexyl-4-ethoxybenzamide
CID 28689929
4-hydroxy-3-methyl-N-(4-propylcyclohexyl)benzamide
CID 107676630

Frequently Asked Questions

What is the IUPAC name of 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide?
The IUPAC name of 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide (CID 67634741) is 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide.
What is the SMILES notation for 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide?
The canonical SMILES for 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide is CCCC1CCc2c(c3cc(C(=O)NC4CCCCC4)ccc3n2N)C1.
What is the InChIKey of 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide?
The InChIKey is ITAKSCWIMJSHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31N3O/c1-2-6-15-9-11-20-18(13-15)19-14-16(10-12-21(19)25(20)23)22(26)24-17-7-4-3-5-8-17/h10,12,14-15,17H,2-9,11,13,23H2,1H3,(H,24,26).
What are the key properties of 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide?
9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide has a molecular weight of 353.51 g/mol, XLogP of 4.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-N-cyclohexyl-6-propyl-5,6,7,8-tetrahydrocarbazole-3-carboxamide is sourced from PubChem (CID 67634741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).