3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide

C20H21N7O — CID 173087002

IUPAC3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide
SMILESCNC(=O)c1cccc(N2C=C(Nc3cc(C4CC4)[nH]n3)n3ccnc3C2)c1
InChIInChI=1S/C20H21N7O/c1-21-20(28)14-3-2-4-15(9-14)26-11-18-22-7-8-27(18)19(12-26)23-17-10-16(24-25-17)13-5-6-13/h2-4,7-10,12-13H,5-6,11H2,1H3,(H,21,28)(H2,23,24,25)
InChIKeyQFNRUZSSABKAIM-UHFFFAOYSA-N
MW375.44 g/mol
LogP2.73
Rot. Bonds5

About 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide

3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide (PubChem CID 173087002) has the molecular formula C20H21N7O and a molecular weight of 375.44 g/mol. Its IUPAC name is 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide.

Molecular Properties

Compound Name3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide
PubChem CID173087002
Molecular FormulaC20H21N7O
Molecular Weight375.44 g/mol
Exact Mass375.18
IUPAC Name3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide
SMILESCNC(=O)c1cccc(N2C=C(Nc3cc(C4CC4)[nH]n3)n3ccnc3C2)c1
InChIInChI=1S/C20H21N7O/c1-21-20(28)14-3-2-4-15(9-14)26-11-18-22-7-8-27(18)19(12-26)23-17-10-16(24-25-17)13-5-6-13/h2-4,7-10,12-13H,5-6,11H2,1H3,(H,21,28)(H2,23,24,25)
InChIKeyQFNRUZSSABKAIM-UHFFFAOYSA-N
XLogP2.73
TPSA90.87 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.44
LogP ≤ 52.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-ethylbenzamide
CID 173087586
7-(3-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)-8H-imidazo[1,2-a]pyrazin-5-amine
CID 173087413
N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2,6-dimethylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine
CID 173087467
N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(4-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine
CID 173087210
7-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)-8H-imidazo[1,2-a]pyrazin-5-amine
CID 173086806
N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine
CID 173086981
7-(5-chloro-2-methoxyphenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)-8H-imidazo[1,2-a]pyrazin-5-amine
CID 173087326
N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-pyrimidin-2-ylsulfonylbenzamide
CID 66872700
[3-fluoro-2-[3-[3-(methylcarbamoyl)phenyl]-2-oxoimidazolidin-1-yl]-4-pyridinyl]boronic acid
CID 178108981
4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-N-methyl-2-pyrrolidin-1-ylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide
CID 170982452
[7-chloro-5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-2-yl]methanol
CID 173086988
phenyl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
CID 95815306

Frequently Asked Questions

What is the IUPAC name of 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide?
The IUPAC name of 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide (CID 173087002) is 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide.
What is the SMILES notation for 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide?
The canonical SMILES for 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide is CNC(=O)c1cccc(N2C=C(Nc3cc(C4CC4)[nH]n3)n3ccnc3C2)c1.
What is the InChIKey of 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide?
The InChIKey is QFNRUZSSABKAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N7O/c1-21-20(28)14-3-2-4-15(9-14)26-11-18-22-7-8-27(18)19(12-26)23-17-10-16(24-25-17)13-5-6-13/h2-4,7-10,12-13H,5-6,11H2,1H3,(H,21,28)(H2,23,24,25).
What are the key properties of 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide?
3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide has a molecular weight of 375.44 g/mol, XLogP of 2.73, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-8H-imidazo[1,2-a]pyrazin-7-yl]-N-methylbenzamide is sourced from PubChem (CID 173087002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).