2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid

C15H13N3O3 — CID 148952571

IUPAC2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CC1c1ccccc1)c1cnccn1
InChIInChI=1S/C15H13N3O3/c19-13(12-9-16-6-7-17-12)18-15(14(20)21)8-11(15)10-4-2-1-3-5-10/h1-7,9,11H,8H2,(H,18,19)(H,20,21)
InChIKeyPQFRSUROGPSJBK-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.22
Rot. Bonds4

About 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid

2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid (PubChem CID 148952571) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid
PubChem CID148952571
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC Name2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CC1c1ccccc1)c1cnccn1
InChIInChI=1S/C15H13N3O3/c19-13(12-9-16-6-7-17-12)18-15(14(20)21)8-11(15)10-4-2-1-3-5-10/h1-7,9,11H,8H2,(H,18,19)(H,20,21)
InChIKeyPQFRSUROGPSJBK-UHFFFAOYSA-N
XLogP1.22
TPSA92.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-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

[3-methyl-1-[[2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropanecarbonyl]amino]butyl]boronic acid
CID 74408219
[(1R)-3-methyl-1-[[(1R,2S)-2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropanecarbonyl]amino]butyl]boronic acid
CID 68768883
1-[(4-chlorobenzoyl)amino]-2-phenylcyclopropane-1-carboxylic acid
CID 84559124
1-(cyclobutanecarbonylamino)-2-phenylcyclopropane-1-carboxylic acid
CID 84559564
1-[(3-methylbenzoyl)amino]-2-phenylcyclopropane-1-carboxylic acid
CID 84559404
N-(1-benzylcyclohexyl)pyrazine-2-carboxamide
CID 110661541
trans-(1S,2R)-1-[[(2S)-2-hydroxypropanoyl]amino]-2-phenylcyclopropane-1-carboxylic acid
CID 176961744
N-[1-(hydroxymethyl)cyclopentyl]pyrazine-2-carboxamide
CID 62519593
trans-(1S,2R)-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylcyclopropane-1-carboxylic acid
CID 7009512
N-[2-[(2R,4S,6R)-4-acetamido-6-phenyloxan-2-yl]ethyl]pyrazine-2-carboxamide
CID 175656500
trans-(1S,2R)-1-(benzylamino)-2-phenylcyclopropane-1-carboxylic acid
CID 89498617
N-(4-methyloxan-4-yl)pyrazine-2-carboxamide
CID 138992437

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid?
The IUPAC name of 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid (CID 148952571) is 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid.
What is the SMILES notation for 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid?
The canonical SMILES for 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid is O=C(NC1(C(=O)O)CC1c1ccccc1)c1cnccn1.
What is the InChIKey of 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid?
The InChIKey is PQFRSUROGPSJBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c19-13(12-9-16-6-7-17-12)18-15(14(20)21)8-11(15)10-4-2-1-3-5-10/h1-7,9,11H,8H2,(H,18,19)(H,20,21).
What are the key properties of 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid?
2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid has a molecular weight of 283.29 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(pyrazine-2-carbonylamino)cyclopropane-1-carboxylic acid is sourced from PubChem (CID 148952571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).