4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide

C16H20N2O2 — CID 112526806

IUPAC4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide
SMILESCc1cc2cccc(NC(=O)C3CCC(O)CC3)c2[nH]1
InChIInChI=1S/C16H20N2O2/c1-10-9-12-3-2-4-14(15(12)17-10)18-16(20)11-5-7-13(19)8-6-11/h2-4,9,11,13,17,19H,5-8H2,1H3,(H,18,20)
InChIKeyXELQLGFQDMYLGU-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.97
Rot. Bonds2

About 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide

4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide (PubChem CID 112526806) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide
PubChem CID112526806
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide
SMILESCc1cc2cccc(NC(=O)C3CCC(O)CC3)c2[nH]1
InChIInChI=1S/C16H20N2O2/c1-10-9-12-3-2-4-14(15(12)17-10)18-16(20)11-5-7-13(19)8-6-11/h2-4,9,11,13,17,19H,5-8H2,1H3,(H,18,20)
InChIKeyXELQLGFQDMYLGU-UHFFFAOYSA-N
XLogP2.97
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 ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dichlorophenyl)-4-hydroxycyclohexane-1-carboxamide
CID 112524536
N-(3-acetamido-2-methylphenyl)cyclopropanecarboxamide
CID 46761229
N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119261898
N-(2,3-dichlorophenyl)cyclopropanecarboxamide
CID 4652086
N-[3-[(4-hydroxycyclohexyl)amino]phenyl]cyclopropanecarboxamide
CID 106593465
N-naphthalen-1-ylpiperidine-4-carboxamide
CID 18073022
N-[3-(cyclopropanecarbonylamino)-2-methylphenyl]-2-iodobenzamide
CID 46761195
1-N,4-N-bis(6-methyl-2-pyridinyl)cyclohexane-1,4-dicarboxamide
CID 25469709
2-[4-(dimethylcarbamoylamino)triazol-2-yl]-N-(2-methyl-1H-indol-7-yl)acetamide
CID 112526816
4-trimethylsilyl-N-[2-[(4-trimethylsilylcyclohexanecarbonyl)amino]phenyl]cyclohexane-1-carboxamide
CID 171577071
N-(1H-benzimidazol-2-yl)-4-hydroxycyclohexane-1-carboxamide
CID 112528043
N-(3-fluoro-2-methylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119281807

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide?
The IUPAC name of 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide (CID 112526806) is 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide is Cc1cc2cccc(NC(=O)C3CCC(O)CC3)c2[nH]1.
What is the InChIKey of 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide?
The InChIKey is XELQLGFQDMYLGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-10-9-12-3-2-4-14(15(12)17-10)18-16(20)11-5-7-13(19)8-6-11/h2-4,9,11,13,17,19H,5-8H2,1H3,(H,18,20).
What are the key properties of 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide?
4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.97, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-methyl-1H-indol-7-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 112526806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).