N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide

C17H23N3O — CID 79117939

IUPACN-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide
SMILESCNC1CCC(N(C)C(=O)c2ccc3[nH]ccc3c2)CC1
InChIInChI=1S/C17H23N3O/c1-18-14-4-6-15(7-5-14)20(2)17(21)13-3-8-16-12(11-13)9-10-19-16/h3,8-11,14-15,18-19H,4-7H2,1-2H3
InChIKeyXSVBYEMFLQMUAN-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.77
Rot. Bonds3

About N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide

N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide (PubChem CID 79117939) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide
PubChem CID79117939
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide
SMILESCNC1CCC(N(C)C(=O)c2ccc3[nH]ccc3c2)CC1
InChIInChI=1S/C17H23N3O/c1-18-14-4-6-15(7-5-14)20(2)17(21)13-3-8-16-12(11-13)9-10-19-16/h3,8-11,14-15,18-19H,4-7H2,1-2H3
InChIKeyXSVBYEMFLQMUAN-UHFFFAOYSA-N
XLogP2.77
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide
CID 144760257
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-1H-indole-5-carboxamide
CID 63719157
3-chloro-4-hydroxy-N-methyl-N-[4-(methylamino)cyclohexyl]benzamide
CID 79110979
3-chloro-N-methyl-N-[4-(methylamino)cyclohexyl]benzamide
CID 79110686
N-cyclopropyl-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763001
N-methyl-N-[4-(methylamino)cyclohexyl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 79119316
2-(cyclopropylamino)-1-(1H-indol-5-yl)ethanone
CID 76849912
2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid
CID 63748053
N-cyclopentyl-N-(2-hydroxyethyl)-1H-indole-5-carboxamide
CID 63748789
N-butyl-N-methyl-1H-indole-5-carboxamide
CID 63717689
N-methyl-N-[4-(methylamino)cyclohexyl]pyridine-3-carboxamide
CID 79122394
N-methyl-N-[1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)azetidin-3-yl]-1H-indole-5-carboxamide
CID 134161665

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide?
The IUPAC name of N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide (CID 79117939) is N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide.
What is the SMILES notation for N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide?
The canonical SMILES for N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide is CNC1CCC(N(C)C(=O)c2ccc3[nH]ccc3c2)CC1.
What is the InChIKey of N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide?
The InChIKey is XSVBYEMFLQMUAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-18-14-4-6-15(7-5-14)20(2)17(21)13-3-8-16-12(11-13)9-10-19-16/h3,8-11,14-15,18-19H,4-7H2,1-2H3.
What are the key properties of N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide?
N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide has a molecular weight of 285.39 g/mol, XLogP of 2.77, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[4-(methylamino)cyclohexyl]-1H-indole-5-carboxamide is sourced from PubChem (CID 79117939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).