N-(4-methylcycloheptyl)furan-2-carboxamide

C13H19NO2 — CID 102795196

IUPACN-(4-methylcycloheptyl)furan-2-carboxamide
SMILESCC1CCCC(NC(=O)c2ccco2)CC1
InChIInChI=1S/C13H19NO2/c1-10-4-2-5-11(8-7-10)14-13(15)12-6-3-9-16-12/h3,6,9-11H,2,4-5,7-8H2,1H3,(H,14,15)
InChIKeyLGLZQVFQLFESEK-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.98
Rot. Bonds2

About N-(4-methylcycloheptyl)furan-2-carboxamide

N-(4-methylcycloheptyl)furan-2-carboxamide (PubChem CID 102795196) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(4-methylcycloheptyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-methylcycloheptyl)furan-2-carboxamide
PubChem CID102795196
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-(4-methylcycloheptyl)furan-2-carboxamide
SMILESCC1CCCC(NC(=O)c2ccco2)CC1
InChIInChI=1S/C13H19NO2/c1-10-4-2-5-11(8-7-10)14-13(15)12-6-3-9-16-12/h3,6,9-11H,2,4-5,7-8H2,1H3,(H,14,15)
InChIKeyLGLZQVFQLFESEK-UHFFFAOYSA-N
XLogP2.98
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclooctylfuran-2-carboxamide
CID 790432
N-[3-[(4-methylcyclohexyl)amino]-3-oxopropyl]furan-2-carboxamide
CID 24633715
N-(3,5-dimethylcyclohexyl)furan-2-carboxamide
CID 64722741
N-(4-bromocyclohexyl)furan-2-carboxamide
CID 114309141
N-[2-[(4-methylcyclohexyl)amino]ethyl]furan-2-carboxamide
CID 3156885
N-[4-(2-hydroxyethyl)cyclohexyl]furan-2-carboxamide
CID 115270358
N-[2-[[(1S,3S)-3-methylcyclohexyl]amino]ethyl]furan-2-carboxamide
CID 7256034
N-[2-[(3-methylcyclohexyl)amino]ethyl]furan-2-carboxamide
CID 3156886
ethyl N-[4-(furan-2-carbonylamino)cyclohexyl]carbamate
CID 100613530
N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]furan-2-carboxamide
CID 40617423
methyl 2-[4-(furan-2-carbonylamino)cyclohexyl]acetate
CID 115270327
N-[2-[(3-methylcyclohexyl)amino]ethyl]furan-2-carboxamide;oxalic acid
CID 126468859

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcycloheptyl)furan-2-carboxamide?
The IUPAC name of N-(4-methylcycloheptyl)furan-2-carboxamide (CID 102795196) is N-(4-methylcycloheptyl)furan-2-carboxamide.
What is the SMILES notation for N-(4-methylcycloheptyl)furan-2-carboxamide?
The canonical SMILES for N-(4-methylcycloheptyl)furan-2-carboxamide is CC1CCCC(NC(=O)c2ccco2)CC1.
What is the InChIKey of N-(4-methylcycloheptyl)furan-2-carboxamide?
The InChIKey is LGLZQVFQLFESEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-10-4-2-5-11(8-7-10)14-13(15)12-6-3-9-16-12/h3,6,9-11H,2,4-5,7-8H2,1H3,(H,14,15).
What are the key properties of N-(4-methylcycloheptyl)furan-2-carboxamide?
N-(4-methylcycloheptyl)furan-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcycloheptyl)furan-2-carboxamide is sourced from PubChem (CID 102795196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).