N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide

C14H22N2O — CID 134004086

IUPACN,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide
SMILESCC1CCCCC1N(C)C(=O)c1cccn1C
InChIInChI=1S/C14H22N2O/c1-11-7-4-5-8-12(11)16(3)14(17)13-9-6-10-15(13)2/h6,9-12H,4-5,7-8H2,1-3H3
InChIKeyWCCDAEMBJXCXDQ-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.68
Rot. Bonds2

About N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide

N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide (PubChem CID 134004086) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide
PubChem CID134004086
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide
SMILESCC1CCCCC1N(C)C(=O)c1cccn1C
InChIInChI=1S/C14H22N2O/c1-11-7-4-5-8-12(11)16(3)14(17)13-9-6-10-15(13)2/h6,9-12H,4-5,7-8H2,1-3H3
InChIKeyWCCDAEMBJXCXDQ-UHFFFAOYSA-N
XLogP2.68
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R,2R,3R)-2-hydroxy-3-methoxycycloheptyl]-N,1-dimethylpyrrole-2-carboxamide
CID 110126014
N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-N,1-dimethylpyrrole-2-carboxamide
CID 43596000
N-(azepan-4-yl)-N,1-dimethylpyrrole-2-carboxamide
CID 104974495
N-methyl-N-(2-methylcyclohexyl)furan-2-carboxamide
CID 42951861
4-amino-1-ethyl-N-methyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide
CID 61104997
4-amino-N-methyl-N-(2-methylcyclohexyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 61104999
3,5-dihydroxy-N-methyl-N-(2-methylcyclohexyl)benzamide
CID 103891881
[(1S,2R)-2-hydroxy-2-methylcyclohexyl]-(1-methylpyrrol-2-yl)methanone
CID 101221371
N,1,5-trimethyl-N-[(1R,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide
CID 94813213
N-[2-(aminomethyl)cyclohexyl]-1-cyclobutyl-N-methylpyrrole-2-carboxamide
CID 114610428
N-methyl-N-(2-methylcyclohexyl)-2-phenyltriazole-4-carboxamide
CID 134004188
N-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 47160097

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide?
The IUPAC name of N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide (CID 134004086) is N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide?
The canonical SMILES for N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide is CC1CCCCC1N(C)C(=O)c1cccn1C.
What is the InChIKey of N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide?
The InChIKey is WCCDAEMBJXCXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-7-4-5-8-12(11)16(3)14(17)13-9-6-10-15(13)2/h6,9-12H,4-5,7-8H2,1-3H3.
What are the key properties of N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide?
N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide has a molecular weight of 234.34 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-(2-methylcyclohexyl)pyrrole-2-carboxamide is sourced from PubChem (CID 134004086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).