N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide

C13H14N6O — CID 74247991

IUPACN-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCc1cc(CNC(=O)c2cn3cccnc3n2)n(C)n1
InChIInChI=1S/C13H14N6O/c1-9-6-10(18(2)17-9)7-15-12(20)11-8-19-5-3-4-14-13(19)16-11/h3-6,8H,7H2,1-2H3,(H,15,20)
InChIKeyUTUJDEOLFZZVIW-UHFFFAOYSA-N
MW270.30 g/mol
LogP0.70
Rot. Bonds3

About N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide

N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide (PubChem CID 74247991) has the molecular formula C13H14N6O and a molecular weight of 270.30 g/mol. Its IUPAC name is N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
PubChem CID74247991
Molecular FormulaC13H14N6O
Molecular Weight270.30 g/mol
Exact Mass270.12
IUPAC NameN-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCc1cc(CNC(=O)c2cn3cccnc3n2)n(C)n1
InChIInChI=1S/C13H14N6O/c1-9-6-10(18(2)17-9)7-15-12(20)11-8-19-5-3-4-14-13(19)16-11/h3-6,8H,7H2,1-2H3,(H,15,20)
InChIKeyUTUJDEOLFZZVIW-UHFFFAOYSA-N
XLogP0.70
TPSA77.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.30
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide (CID 74247991) is N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide is Cc1cc(CNC(=O)c2cn3cccnc3n2)n(C)n1.
What is the InChIKey of N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The InChIKey is UTUJDEOLFZZVIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6O/c1-9-6-10(18(2)17-9)7-15-12(20)11-8-19-5-3-4-14-13(19)16-11/h3-6,8H,7H2,1-2H3,(H,15,20).
What are the key properties of N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide has a molecular weight of 270.30 g/mol, XLogP of 0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethylpyrazol-3-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 74247991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).