N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide

C16H20N2O2 — CID 110885323

IUPACN-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2cc(C(=O)NC3CCC(O)CC3)[nH]c2c1
InChIInChI=1S/C16H20N2O2/c1-10-2-3-11-9-15(18-14(11)8-10)16(20)17-12-4-6-13(19)7-5-12/h2-3,8-9,12-13,18-19H,4-7H2,1H3,(H,17,20)
InChIKeyNDGZIXDLFGNQIS-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.51
Rot. Bonds2

About N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide

N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide (PubChem CID 110885323) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide
PubChem CID110885323
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2cc(C(=O)NC3CCC(O)CC3)[nH]c2c1
InChIInChI=1S/C16H20N2O2/c1-10-2-3-11-9-15(18-14(11)8-10)16(20)17-12-4-6-13(19)7-5-12/h2-3,8-9,12-13,18-19H,4-7H2,1H3,(H,17,20)
InChIKeyNDGZIXDLFGNQIS-UHFFFAOYSA-N
XLogP2.51
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-cycloheptyl-6-methyl-1H-indole-2-carboxamide
CID 113207326
cis-(1S,3R)-3-[(6-methyl-1H-indole-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120677007
N-cyclohexyl-5-methyl-1H-indole-2-carboxamide
CID 3886919
6-methyl-N-(6,7,8,9-tetrahydro-5H-tetrazolo[1,5-a]azepin-7-yl)-1H-indole-2-carboxamide
CID 128866997
N-cyclooctyl-6-hydroxy-1H-indole-2-carboxamide
CID 171355249
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-6-methyl-1H-indole-2-carboxamide
CID 110901916
N-(hydroxymethyl)-6-methyl-1H-indole-2-carboxamide
CID 177170209
6-methyl-N-propan-2-yl-1H-indole-2-carboxamide
CID 110847855
N-(4-aminocyclohexyl)-1H-indole-2-carboxamide
CID 62318715
4-fluoro-N-(4-hydroxycyclohexyl)-1H-indole-2-carboxamide
CID 134010426
5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide
CID 47375273
N-(2,6-dimethylphenyl)-6-methyl-1H-indole-2-carboxamide
CID 113207344

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide (CID 110885323) is N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide is Cc1ccc2cc(C(=O)NC3CCC(O)CC3)[nH]c2c1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide?
The InChIKey is NDGZIXDLFGNQIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-10-2-3-11-9-15(18-14(11)8-10)16(20)17-12-4-6-13(19)7-5-12/h2-3,8-9,12-13,18-19H,4-7H2,1H3,(H,17,20).
What are the key properties of N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide?
N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.51, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide is sourced from PubChem (CID 110885323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).