3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid

C11H13N3O3 — CID 66032324

IUPAC3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1CCC(C(=O)O)C1)c1cnccn1
InChIInChI=1S/C11H13N3O3/c15-10(9-6-12-3-4-13-9)14-8-2-1-7(5-8)11(16)17/h3-4,6-8H,1-2,5H2,(H,14,15)(H,16,17)
InChIKeyHBVDNIXFTSOWKD-UHFFFAOYSA-N
MW235.24 g/mol
LogP0.46
Rot. Bonds3

About 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid

3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid (PubChem CID 66032324) has the molecular formula C11H13N3O3 and a molecular weight of 235.24 g/mol. Its IUPAC name is 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid
PubChem CID66032324
Molecular FormulaC11H13N3O3
Molecular Weight235.24 g/mol
Exact Mass235.10
IUPAC Name3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1CCC(C(=O)O)C1)c1cnccn1
InChIInChI=1S/C11H13N3O3/c15-10(9-6-12-3-4-13-9)14-8-2-1-7(5-8)11(16)17/h3-4,6-8H,1-2,5H2,(H,14,15)(H,16,17)
InChIKeyHBVDNIXFTSOWKD-UHFFFAOYSA-N
XLogP0.46
TPSA92.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

cis-(1R,3S)-3-[(6-chloropyrazine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106321292
N-(4,4-dimethylcyclohexyl)pyrazine-2-carboxamide
CID 130233496
cis-(1R,3S)-3-[(5-fluoropyridine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106320712
cis-(1R,3S)-3-[(4-phenoxypyridine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120677474
cis-(1S,3R)-3-(1,2,5-thiadiazole-3-carbonylamino)cyclopentane-1-carboxylic acid
CID 120675557
cis-(1R,3S)-3-[(3-aminopyrazine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120678525
N'-(cyclopropanecarbonyl)pyrazine-2-carbohydrazide
CID 34260535
N-[4-(2-methylbutan-2-yl)cyclohexyl]pyrazine-2-carboxamide
CID 18155873
cis-(1R,3S)-3-[[5-(trifluoromethyl)pyridine-2-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 106321029
N-(1-tert-butylazetidin-3-yl)pyrazine-2-carboxamide
CID 89460399
N-(1-methylpiperidin-3-yl)pyrazine-2-carboxamide
CID 110471343
cis-(1R,3S)-3-[(4-methylpyrimidine-5-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120677737

Frequently Asked Questions

What is the IUPAC name of 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid (CID 66032324) is 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid is O=C(NC1CCC(C(=O)O)C1)c1cnccn1.
What is the InChIKey of 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid?
The InChIKey is HBVDNIXFTSOWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O3/c15-10(9-6-12-3-4-13-9)14-8-2-1-7(5-8)11(16)17/h3-4,6-8H,1-2,5H2,(H,14,15)(H,16,17).
What are the key properties of 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid?
3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid has a molecular weight of 235.24 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 66032324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).