2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid

C14H8N4O2 — CID 63991934

IUPAC2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid
SMILESN#Cc1cccc(-c2cn3ccnc(C(=O)O)c3n2)c1
InChIInChI=1S/C14H8N4O2/c15-7-9-2-1-3-10(6-9)11-8-18-5-4-16-12(14(19)20)13(18)17-11/h1-6,8H,(H,19,20)
InChIKeyIAMYKBDNSHRPNX-UHFFFAOYSA-N
MW264.24 g/mol
LogP1.97
Rot. Bonds2

About 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid

2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid (PubChem CID 63991934) has the molecular formula C14H8N4O2 and a molecular weight of 264.24 g/mol. Its IUPAC name is 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid.

Molecular Properties

Compound Name2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid
PubChem CID63991934
Molecular FormulaC14H8N4O2
Molecular Weight264.24 g/mol
Exact Mass264.06
IUPAC Name2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid
SMILESN#Cc1cccc(-c2cn3ccnc(C(=O)O)c3n2)c1
InChIInChI=1S/C14H8N4O2/c15-7-9-2-1-3-10(6-9)11-8-18-5-4-16-12(14(19)20)13(18)17-11/h1-6,8H,(H,19,20)
InChIKeyIAMYKBDNSHRPNX-UHFFFAOYSA-N
XLogP1.97
TPSA91.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.24
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-methoxyphenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid
CID 63259837
2-(3-cyanophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxylic acid
CID 131988138
fluoro 3-(3-cyanophenyl)pyrrolo[1,2-a]pyrazine-1-carboxylate
CID 153350480
1-(3-cyanophenyl)-3-[3-[8-(pyridin-4-ylmethylamino)imidazo[1,2-a]pyrazin-6-yl]phenyl]urea
CID 46878990
3-(8-oxo-7H-imidazo[1,2-a]pyrazin-6-yl)benzonitrile
CID 139721047
3-(2-phenyl-1,3-thiazol-4-yl)benzonitrile
CID 55219786
3-(8-aminoimidazo[1,2-a]pyridin-2-yl)benzoic acid;hydrobromide
CID 67712220
ethyl 2-(3-cyanophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxylate
CID 131988139
3-[1-(3-cyanophenyl)triazol-4-yl]benzonitrile
CID 44626496
3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzonitrile
CID 122476393
N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide
CID 170129039
3-[(2-phenylimidazol-1-yl)methyl]benzonitrile
CID 61071786

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid?
The IUPAC name of 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid (CID 63991934) is 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid.
What is the SMILES notation for 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid?
The canonical SMILES for 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid is N#Cc1cccc(-c2cn3ccnc(C(=O)O)c3n2)c1.
What is the InChIKey of 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid?
The InChIKey is IAMYKBDNSHRPNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N4O2/c15-7-9-2-1-3-10(6-9)11-8-18-5-4-16-12(14(19)20)13(18)17-11/h1-6,8H,(H,19,20).
What are the key properties of 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid?
2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid has a molecular weight of 264.24 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyanophenyl)imidazo[1,2-a]pyrazine-8-carboxylic acid is sourced from PubChem (CID 63991934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).