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

C15H20N2O4 — CID 66031040

IUPAC3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCC(NC(=O)N(Cc2ccco2)C2CC2)C1
InChIInChI=1S/C15H20N2O4/c18-14(19)10-3-4-11(8-10)16-15(20)17(12-5-6-12)9-13-2-1-7-21-13/h1-2,7,10-12H,3-6,8-9H2,(H,16,20)(H,18,19)
InChIKeyGWUDPPBDCALFGA-UHFFFAOYSA-N
MW292.33 g/mol
LogP2.21
Rot. Bonds5

About 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid

3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 66031040) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
PubChem CID66031040
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCC(NC(=O)N(Cc2ccco2)C2CC2)C1
InChIInChI=1S/C15H20N2O4/c18-14(19)10-3-4-11(8-10)16-15(20)17(12-5-6-12)9-13-2-1-7-21-13/h1-2,7,10-12H,3-6,8-9H2,(H,16,20)(H,18,19)
InChIKeyGWUDPPBDCALFGA-UHFFFAOYSA-N
XLogP2.21
TPSA82.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[cyclopropyl(furan-2-ylmethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63782822
4-[[benzyl(furan-2-ylmethyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 122025242
cis-(1R,3S)-3-[[2-(furan-2-ylmethylcarbamoylamino)acetyl]amino]cyclopentane-1-carboxylic acid
CID 120678128
2-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]-3-hydroxypropanoic acid
CID 55003505
N-cyclopropyl-N-(furan-2-ylmethyl)benzamide
CID 47022966
3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]-3-methylbutanoic acid
CID 64700693
4-[[2-[furan-2-ylmethyl(methyl)amino]-2-oxoethyl]amino]cyclohexane-1-carboxylic acid
CID 60809869
(2R)-2-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]-3,3-dimethylbutanoic acid
CID 103927859
2-[[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]methyl]pentanoic acid
CID 65222818
4-[[cyclopropyl(naphthalen-2-ylmethyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 122025022
N-cyclopropyl-N-(furan-2-ylmethyl)-3-sulfanylpropanamide
CID 107026655
3-[[butyl(cyclopropyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 66030439

Frequently Asked Questions

What is the IUPAC name of 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid (CID 66031040) is 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid is O=C(O)C1CCC(NC(=O)N(Cc2ccco2)C2CC2)C1.
What is the InChIKey of 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is GWUDPPBDCALFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c18-14(19)10-3-4-11(8-10)16-15(20)17(12-5-6-12)9-13-2-1-7-21-13/h1-2,7,10-12H,3-6,8-9H2,(H,16,20)(H,18,19).
What are the key properties of 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 292.33 g/mol, XLogP of 2.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 66031040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).