N-cycloheptyl-6-methyl-1H-indole-2-carboxamide

C17H22N2O — CID 113207326

IUPACN-cycloheptyl-6-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2cc(C(=O)NC3CCCCCC3)[nH]c2c1
InChIInChI=1S/C17H22N2O/c1-12-8-9-13-11-16(19-15(13)10-12)17(20)18-14-6-4-2-3-5-7-14/h8-11,14,19H,2-7H2,1H3,(H,18,20)
InChIKeyJTBKERSECIPTMD-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.93
Rot. Bonds2

About N-cycloheptyl-6-methyl-1H-indole-2-carboxamide

N-cycloheptyl-6-methyl-1H-indole-2-carboxamide (PubChem CID 113207326) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-cycloheptyl-6-methyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-6-methyl-1H-indole-2-carboxamide
PubChem CID113207326
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-cycloheptyl-6-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2cc(C(=O)NC3CCCCCC3)[nH]c2c1
InChIInChI=1S/C17H22N2O/c1-12-8-9-13-11-16(19-15(13)10-12)17(20)18-14-6-4-2-3-5-7-14/h8-11,14,19H,2-7H2,1H3,(H,18,20)
InChIKeyJTBKERSECIPTMD-UHFFFAOYSA-N
XLogP3.93
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclohexyl-5-methyl-1H-indole-2-carboxamide
CID 3886919
N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide
CID 110885323
N-cyclooctyl-6-hydroxy-1H-indole-2-carboxamide
CID 171355249
cis-(1S,3R)-3-[(6-methyl-1H-indole-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120677007
N-cyclohexyl-6-(trifluoromethyl)-1H-indole-2-carboxamide
CID 171354096
6-methyl-N-(6,7,8,9-tetrahydro-5H-tetrazolo[1,5-a]azepin-7-yl)-1H-indole-2-carboxamide
CID 128866997
6-methyl-N-propan-2-yl-1H-indole-2-carboxamide
CID 110847855
1-cyclohexyl-3-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]urea
CID 110324549
N-(hydroxymethyl)-6-methyl-1H-indole-2-carboxamide
CID 177170209
N-cyclohexyl-2,5-dimethylbenzamide
CID 925443
5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide
CID 47375273
N-cyclododecyl-2,4-dimethylbenzamide
CID 19656258

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-6-methyl-1H-indole-2-carboxamide?
The IUPAC name of N-cycloheptyl-6-methyl-1H-indole-2-carboxamide (CID 113207326) is N-cycloheptyl-6-methyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-6-methyl-1H-indole-2-carboxamide?
The canonical SMILES for N-cycloheptyl-6-methyl-1H-indole-2-carboxamide is Cc1ccc2cc(C(=O)NC3CCCCCC3)[nH]c2c1.
What is the InChIKey of N-cycloheptyl-6-methyl-1H-indole-2-carboxamide?
The InChIKey is JTBKERSECIPTMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-12-8-9-13-11-16(19-15(13)10-12)17(20)18-14-6-4-2-3-5-7-14/h8-11,14,19H,2-7H2,1H3,(H,18,20).
What are the key properties of N-cycloheptyl-6-methyl-1H-indole-2-carboxamide?
N-cycloheptyl-6-methyl-1H-indole-2-carboxamide has a molecular weight of 270.38 g/mol, XLogP of 3.93, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-6-methyl-1H-indole-2-carboxamide is sourced from PubChem (CID 113207326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).