2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid

C10H11N3O3 — CID 62695126

IUPAC2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid
SMILESO=C(NC(C(=O)O)C1CC1)c1cnccn1
InChIInChI=1S/C10H11N3O3/c14-9(7-5-11-3-4-12-7)13-8(10(15)16)6-1-2-6/h3-6,8H,1-2H2,(H,13,14)(H,15,16)
InChIKeyINURXHXFAFXPKF-UHFFFAOYSA-N
MW221.22 g/mol
LogP0.07
Rot. Bonds4

About 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid

2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid (PubChem CID 62695126) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid.

Molecular Properties

Compound Name2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid
PubChem CID62695126
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC Name2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid
SMILESO=C(NC(C(=O)O)C1CC1)c1cnccn1
InChIInChI=1S/C10H11N3O3/c14-9(7-5-11-3-4-12-7)13-8(10(15)16)6-1-2-6/h3-6,8H,1-2H2,(H,13,14)(H,15,16)
InChIKeyINURXHXFAFXPKF-UHFFFAOYSA-N
XLogP0.07
TPSA92.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(2S)-2-cyclohexyl-2-(pyrazine-2-carbonylamino)acetyl]amino]-3,3-dimethylbutanoic acid
CID 67395867
(2S)-3-cyclobutyl-2-(pyrazine-2-carbonylamino)propanoic acid
CID 162739047
N-(2-amino-1-cyclopropylethyl)pyrazine-2-carboxamide;dihydrochloride
CID 119616630
2-cyclopropyl-2-(thiadiazole-4-carbonylamino)acetic acid
CID 65214444
(2S)-2-[[3-cyclohexyl-3-(pyrazine-2-carbonylamino)prop-1-en-2-yl]amino]-3,3-dimethylpentanoic acid
CID 90269503
2-cyclohexyl-2-[(5-methylpyrazine-2-carbonyl)amino]acetic acid
CID 61014498
N-[cyclopropyl-(4-methylphenyl)methyl]pyrazine-2-carboxamide
CID 47016466
(2S)-2-(pyrazine-2-carbonylamino)butanedioic acid
CID 112733139
N-[(1S,4S)-4-tert-butyl-1-cyclohexyl-5-hydroxy-2-oxohex-5-enyl]pyrazine-2-carboxamide
CID 159024590
2-cyclopropyl-2-[(5-pyridin-3-yl-1,2-oxazole-3-carbonyl)amino]acetic acid
CID 119213726
ethane;N-propan-2-ylpyrazine-2-carboxamide
CID 143147775
(2S)-4-hydroxy-2-(pyrazine-2-carbonylamino)butanoic acid
CID 107822419

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid?
The IUPAC name of 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid (CID 62695126) is 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid.
What is the SMILES notation for 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid?
The canonical SMILES for 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid is O=C(NC(C(=O)O)C1CC1)c1cnccn1.
What is the InChIKey of 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid?
The InChIKey is INURXHXFAFXPKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c14-9(7-5-11-3-4-12-7)13-8(10(15)16)6-1-2-6/h3-6,8H,1-2H2,(H,13,14)(H,15,16).
What are the key properties of 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid?
2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid has a molecular weight of 221.22 g/mol, XLogP of 0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(pyrazine-2-carbonylamino)acetic acid is sourced from PubChem (CID 62695126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).