3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile

C14H10ClN5 — CID 171660535

IUPAC3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile
SMILESCc1ncc(Cl)c(-c2cnn3c(C)c(C#N)ccc23)n1
InChIInChI=1S/C14H10ClN5/c1-8-10(5-16)3-4-13-11(6-18-20(8)13)14-12(15)7-17-9(2)19-14/h3-4,6-7H,1-2H3
InChIKeyHQWSKGUCGHZUKE-UHFFFAOYSA-N
MW283.72 g/mol
LogP2.93
Rot. Bonds1

About 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile

3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile (PubChem CID 171660535) has the molecular formula C14H10ClN5 and a molecular weight of 283.72 g/mol. Its IUPAC name is 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile.

Molecular Properties

Compound Name3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile
PubChem CID171660535
Molecular FormulaC14H10ClN5
Molecular Weight283.72 g/mol
Exact Mass283.06
IUPAC Name3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile
SMILESCc1ncc(Cl)c(-c2cnn3c(C)c(C#N)ccc23)n1
InChIInChI=1S/C14H10ClN5/c1-8-10(5-16)3-4-13-11(6-18-20(8)13)14-12(15)7-17-9(2)19-14/h3-4,6-7H,1-2H3
InChIKeyHQWSKGUCGHZUKE-UHFFFAOYSA-N
XLogP2.93
TPSA66.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.72
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-2-methyl-4-(1-pentan-3-ylpyrazol-4-yl)pyrimidine;ethane
CID 171627145
5,7-dichloro-6-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 114514531
2,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
CID 82411692
7-methylpyrazolo[1,5-a]pyrimidine-6-carbonitrile
CID 82415789
2-methyl-4-(trifluoromethyl)pyrimidine-5-carbonitrile
CID 82655671
3-bromo-6-chloro-7-methylpyrazolo[1,5-a]pyridine
CID 130066039
2-[4-[(5-chloro-2-methylpyrimidin-4-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 135087837
7-chloro-5-methyl-6-(2-phenoxyethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 82274397
5,7-dichloro-6-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 114514536
5,7-dichloro-6-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 114514541
6-(5-chloro-2-methylpyrimidin-4-yl)-4-fluoro-1-propan-2-ylbenzimidazole;ethane
CID 176685593
2-chloro-6-ethoxypyridine-3-carbonitrile
CID 14687435

Frequently Asked Questions

What is the IUPAC name of 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile?
The IUPAC name of 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile (CID 171660535) is 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile.
What is the SMILES notation for 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile?
The canonical SMILES for 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile is Cc1ncc(Cl)c(-c2cnn3c(C)c(C#N)ccc23)n1.
What is the InChIKey of 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile?
The InChIKey is HQWSKGUCGHZUKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN5/c1-8-10(5-16)3-4-13-11(6-18-20(8)13)14-12(15)7-17-9(2)19-14/h3-4,6-7H,1-2H3.
What are the key properties of 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile?
3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile has a molecular weight of 283.72 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chloro-2-methylpyrimidin-4-yl)-7-methylpyrazolo[1,5-a]pyridine-6-carbonitrile is sourced from PubChem (CID 171660535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).