1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid

C13H18N2O4 — CID 61197524

IUPAC1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
SMILESCN(Cc1ccco1)C(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C13H18N2O4/c1-15(9-10-5-4-8-19-10)12(18)14-13(11(16)17)6-2-3-7-13/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,18)(H,16,17)
InChIKeyHWLGNFSAJKNPNZ-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.82
Rot. Bonds4

About 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid

1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 61197524) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
PubChem CID61197524
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
SMILESCN(Cc1ccco1)C(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C13H18N2O4/c1-15(9-10-5-4-8-19-10)12(18)14-13(11(16)17)6-2-3-7-13/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,18)(H,16,17)
InChIKeyHWLGNFSAJKNPNZ-UHFFFAOYSA-N
XLogP1.82
TPSA82.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid 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-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclobutane-1-carboxylic acid
CID 81163076
methyl 1-aminocyclohexane-1-carboxylate;methyl 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclohexane-1-carboxylate
CID 161049648
1-[[[furan-2-ylmethyl(methyl)carbamoyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 115434026
1-[[methyl-[(2-methylfuran-3-yl)methyl]carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 61424074
1-(furan-2-ylmethylamino)cycloheptane-1-carboxylic acid
CID 114990379
1-[1-(furan-2-yl)propan-2-ylamino]cyclopentane-1-carboxylic acid
CID 114990407
2-(1-aminocyclohexyl)-N-(furan-2-ylmethyl)-N-methylacetamide
CID 64683581
1-(furan-2-ylmethoxycarbonylamino)cyclohexane-1-carboxylic acid;methyl 1-(furan-2-ylmethoxycarbonylamino)cyclohexane-1-carboxylate
CID 158095708
4-[[furan-2-ylmethyl(methyl)carbamoyl]amino]-3-methyloxolane-3-carboxylic acid
CID 66250151
1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 43151464
methyl N-(furan-2-ylmethyl)-N-methylcarbamate
CID 2755161
1-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylcyclobutane-1-carboxamide
CID 80587658

Frequently Asked Questions

What is the IUPAC name of 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid (CID 61197524) is 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid is CN(Cc1ccco1)C(=O)NC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is HWLGNFSAJKNPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-15(9-10-5-4-8-19-10)12(18)14-13(11(16)17)6-2-3-7-13/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,18)(H,16,17).
What are the key properties of 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 266.30 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 61197524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).