1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid

C11H13NO4 — CID 43151464

IUPAC1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCCC1)c1ccco1
InChIInChI=1S/C11H13NO4/c13-9(8-4-3-7-16-8)12-11(10(14)15)5-1-2-6-11/h3-4,7H,1-2,5-6H2,(H,12,13)(H,14,15)
InChIKeyKOIDKVQCJIXQEI-UHFFFAOYSA-N
MW223.23 g/mol
LogP1.41
Rot. Bonds3

About 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid

1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid (PubChem CID 43151464) has the molecular formula C11H13NO4 and a molecular weight of 223.23 g/mol. Its IUPAC name is 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid
PubChem CID43151464
Molecular FormulaC11H13NO4
Molecular Weight223.23 g/mol
Exact Mass223.08
IUPAC Name1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCCC1)c1ccco1
InChIInChI=1S/C11H13NO4/c13-9(8-4-3-7-16-8)12-11(10(14)15)5-1-2-6-11/h3-4,7H,1-2,5-6H2,(H,12,13)(H,14,15)
InChIKeyKOIDKVQCJIXQEI-UHFFFAOYSA-N
XLogP1.41
TPSA79.54 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyanocyclooctyl)furan-2-carboxamide
CID 54904517
1-[(2-bromofuran-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106850899
1-[1-(furan-2-yl)ethylcarbamoylamino]cycloheptane-1-carboxylic acid
CID 61197564
3-[[2-(furan-2-carbonylamino)acetyl]amino]oxolane-3-carboxylic acid
CID 64887873
1-[[furan-2-ylmethyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 61197524
2-(furan-2-carbonylamino)-1-methylcyclohexane-1-carboxylic acid
CID 83214512
1-[(2,6-difluorobenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43162964
1-(furan-2-ylmethylamino)cycloheptane-1-carboxylic acid
CID 114990379
N-[(1-hydroxycyclohexyl)methyl]furan-2-carboxamide
CID 64866996
1-[[2-[(2-phenylacetyl)amino]acetyl]amino]cyclopentane-1-carboxylic acid
CID 119176363
1-[(7-bromo-1-benzofuran-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 61218012
N-[(1-aminocyclohexyl)methyl]furan-2-carboxamide
CID 119404531

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid (CID 43151464) is 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid is O=C(NC1(C(=O)O)CCCC1)c1ccco1.
What is the InChIKey of 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid?
The InChIKey is KOIDKVQCJIXQEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO4/c13-9(8-4-3-7-16-8)12-11(10(14)15)5-1-2-6-11/h3-4,7H,1-2,5-6H2,(H,12,13)(H,14,15).
What are the key properties of 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid?
1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid has a molecular weight of 223.23 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 43151464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).