N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide

C12H18N2O2 — CID 119404531

IUPACN-[(1-aminocyclohexyl)methyl]furan-2-carboxamide
SMILESNC1(CNC(=O)c2ccco2)CCCCC1
InChIInChI=1S/C12H18N2O2/c13-12(6-2-1-3-7-12)9-14-11(15)10-5-4-8-16-10/h4-5,8H,1-3,6-7,9,13H2,(H,14,15)
InChIKeyPCPZXXPCJCZEFN-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.67
Rot. Bonds3

About N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide

N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide (PubChem CID 119404531) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(1-aminocyclohexyl)methyl]furan-2-carboxamide
PubChem CID119404531
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-[(1-aminocyclohexyl)methyl]furan-2-carboxamide
SMILESNC1(CNC(=O)c2ccco2)CCCCC1
InChIInChI=1S/C12H18N2O2/c13-12(6-2-1-3-7-12)9-14-11(15)10-5-4-8-16-10/h4-5,8H,1-3,6-7,9,13H2,(H,14,15)
InChIKeyPCPZXXPCJCZEFN-UHFFFAOYSA-N
XLogP1.67
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1-hydroxycyclohexyl)methyl]furan-2-carboxamide
CID 64866996
N-[(1-methylcyclobutyl)methyl]furan-2-carboxamide
CID 103737372
benzyl N-[(1-aminocycloheptyl)methyl]carbamate
CID 66523425
N-[(1-aminocyclohexyl)methyl]-2-(3-bromophenyl)acetamide
CID 119404421
N-[(4-hydroxy-6,7-dihydro-5H-1-benzofuran-4-yl)methyl]furan-2-carboxamide
CID 134161530
N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]furan-2-carboxamide
CID 41412119
1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 43151464
N-[(4-hydroxy-2,3-dihydrochromen-4-yl)methyl]furan-2-carboxamide
CID 71788867
N-[[1-(3-chlorophenyl)cyclopropyl]methyl]furan-2-carboxamide
CID 110443400
N-(1-cyanocyclooctyl)furan-2-carboxamide
CID 54904517
N-[(1-aminocycloheptyl)methyl]furan-2-sulfonamide
CID 120875673
N-[(1-aminocyclohexyl)methyl]-3-methylpyridine-2-carboxamide
CID 119404249

Frequently Asked Questions

What is the IUPAC name of N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide?
The IUPAC name of N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide (CID 119404531) is N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide?
The canonical SMILES for N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide is NC1(CNC(=O)c2ccco2)CCCCC1.
What is the InChIKey of N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide?
The InChIKey is PCPZXXPCJCZEFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c13-12(6-2-1-3-7-12)9-14-11(15)10-5-4-8-16-10/h4-5,8H,1-3,6-7,9,13H2,(H,14,15).
What are the key properties of N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide?
N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 119404531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).