1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide

C12H18N2O2 — CID 80587658

IUPAC1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide
SMILESCN(Cc1ccco1)C(=O)C1(CN)CCC1
InChIInChI=1S/C12H18N2O2/c1-14(8-10-4-2-7-16-10)11(15)12(9-13)5-3-6-12/h2,4,7H,3,5-6,8-9,13H2,1H3
InChIKeyFDJOSPMJOXLPFJ-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.37
Rot. Bonds4

About 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide

1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide (PubChem CID 80587658) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide
PubChem CID80587658
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide
SMILESCN(Cc1ccco1)C(=O)C1(CN)CCC1
InChIInChI=1S/C12H18N2O2/c1-14(8-10-4-2-7-16-10)11(15)12(9-13)5-3-6-12/h2,4,7H,3,5-6,8-9,13H2,1H3
InChIKeyFDJOSPMJOXLPFJ-UHFFFAOYSA-N
XLogP1.37
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-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

1-(aminomethyl)-N-cyclopentyl-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide
CID 115434996
N-(furan-2-ylmethyl)-N-methyl-3-propylpiperidine-3-carboxamide
CID 55165654
1-(aminomethyl)-N-cyclopentyl-N-(furan-2-ylmethyl)cyclopropane-1-carboxamide
CID 115452816
1-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]cyclobutane-1-carboxamide
CID 80588544
1-(aminomethyl)-N-[(2-bromophenyl)methyl]-N-methylcyclobutane-1-carboxamide
CID 115447915
2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide
CID 64683581
1-[[[furan-2-ylmethyl(methyl)carbamoyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 115434026
1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclobutane-1-carboxylic acid
CID 81163076
1-(aminomethyl)-N-[(2,5-difluorophenyl)methyl]-N-methylcyclobutane-1-carboxamide
CID 115183542
1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 61197524
1-(aminomethyl)-N-[(2,3-dichlorophenyl)methyl]-N-methylcyclohexane-1-carboxamide
CID 115437487
methyl N-(furan-2-ylmethyl)-N-methylcarbamate
CID 2755161

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide (CID 80587658) is 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide is CN(Cc1ccco1)C(=O)C1(CN)CCC1.
What is the InChIKey of 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide?
The InChIKey is FDJOSPMJOXLPFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-14(8-10-4-2-7-16-10)11(15)12(9-13)5-3-6-12/h2,4,7H,3,5-6,8-9,13H2,1H3.
What are the key properties of 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide?
1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide is sourced from PubChem (CID 80587658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).