N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide

C14H23NO — CID 71929788

IUPACN-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NC1CCCC(C2CC2)C1
InChIInChI=1S/C14H23NO/c1-9-7-13(9)14(16)15-12-4-2-3-11(8-12)10-5-6-10/h9-13H,2-8H2,1H3,(H,15,16)
InChIKeyQCLFIMYJAVLOSV-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.73
Rot. Bonds3

About N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide

N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide (PubChem CID 71929788) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide
PubChem CID71929788
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC NameN-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NC1CCCC(C2CC2)C1
InChIInChI=1S/C14H23NO/c1-9-7-13(9)14(16)15-12-4-2-3-11(8-12)10-5-6-10/h9-13H,2-8H2,1H3,(H,15,16)
InChIKeyQCLFIMYJAVLOSV-UHFFFAOYSA-N
XLogP2.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-aminocyclohexyl)-2-methylcyclopropane-1-carboxamide
CID 130816162
N-[(3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-yl]-2-methylcyclopropane-1-carboxamide
CID 43603815
N-[(3aR,5R,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl]acetamide
CID 131102398
tert-butyl N-[(1R,3S)-3-[[(1S,2R)-2-methylcyclopropanecarbonyl]amino]cyclohexyl]carbamate
CID 129446084
2-methyl-N-(3-methylcyclopentyl)cyclopropane-1-carboxamide
CID 114549485
cis-(1S,3R)-3-[[(1S,2R)-2-methylcyclopropanecarbonyl]amino]cyclopentane-1-carboxylic acid
CID 97030816
2-methyl-N-(3-methylcyclobutyl)cyclopropane-1-carboxamide
CID 130668952
trans-(1S,2S)-2-methyl-N-[(3S)-oxan-3-yl]cyclopropane-1-carboxamide
CID 131113536
2-(cyclobutylcarbamoyl)cyclobutane-1-carboxylic acid
CID 130735456
trans-(1S,2S)-N-[(1R,2S)-2-cyclopropylcyclopropyl]-2-methylcyclopropane-1-carboxamide
CID 131165871
N-(4-cyclooctylcycloheptyl)acetamide
CID 170008813
2-methyl-N-(2-methylcyclohexyl)cyclopropane-1-carboxamide
CID 4084655

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide (CID 71929788) is N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)NC1CCCC(C2CC2)C1.
What is the InChIKey of N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide?
The InChIKey is QCLFIMYJAVLOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-9-7-13(9)14(16)15-12-4-2-3-11(8-12)10-5-6-10/h9-13H,2-8H2,1H3,(H,15,16).
What are the key properties of N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide?
N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide has a molecular weight of 221.34 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropylcyclohexyl)-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 71929788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).