2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine

C9H10ClN5 — CID 22309464

IUPAC2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine
SMILESCc1cc(Nc2ccnc(Cl)n2)n(C)n1
InChIInChI=1S/C9H10ClN5/c1-6-5-8(15(2)14-6)12-7-3-4-11-9(10)13-7/h3-5H,1-2H3,(H,11,12,13)
InChIKeyHRTKUIAXCYPYPK-UHFFFAOYSA-N
MW223.67 g/mol
LogP1.92
Rot. Bonds2

About 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine

2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine (PubChem CID 22309464) has the molecular formula C9H10ClN5 and a molecular weight of 223.67 g/mol. Its IUPAC name is 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine
PubChem CID22309464
Molecular FormulaC9H10ClN5
Molecular Weight223.67 g/mol
Exact Mass223.06
IUPAC Name2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine
SMILESCc1cc(Nc2ccnc(Cl)n2)n(C)n1
InChIInChI=1S/C9H10ClN5/c1-6-5-8(15(2)14-6)12-7-3-4-11-9(10)13-7/h3-5H,1-2H3,(H,11,12,13)
InChIKeyHRTKUIAXCYPYPK-UHFFFAOYSA-N
XLogP1.92
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.67
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-chloropyrimidin-4-yl)-2,3,5-trimethylindazol-6-amine
CID 58936383
5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine
CID 141267684
2-chloro-N-(3-methylphenyl)pyrimidin-4-amine
CID 46859551
2-chloro-N-(4-fluoro-3-methylphenyl)pyrimidin-4-amine
CID 59828373
2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 67388167
2-chloro-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyrimidin-4-amine
CID 80688951
N-(2,5-dimethylpyrazol-3-yl)-4-(4-methylphenyl)-1,3-thiazol-2-amine
CID 25498040
2-chloro-N-(4-propan-2-ylphenyl)pyrimidin-4-amine
CID 60727037
2-chloro-N-(3,4,5-trifluorophenyl)pyrimidin-4-amine
CID 62814283
2-chloro-N-(4-methylsulfanylphenyl)pyrimidin-4-amine
CID 62336213
2-[(2,5-dimethylpyrazol-3-yl)amino]pyridine-3-carboxylic acid
CID 71016995
2-chloro-N-(3-propan-2-ylphenyl)pyrimidin-4-amine
CID 60726103

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine?
The IUPAC name of 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine (CID 22309464) is 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine?
The canonical SMILES for 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine is Cc1cc(Nc2ccnc(Cl)n2)n(C)n1.
What is the InChIKey of 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine?
The InChIKey is HRTKUIAXCYPYPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN5/c1-6-5-8(15(2)14-6)12-7-3-4-11-9(10)13-7/h3-5H,1-2H3,(H,11,12,13).
What are the key properties of 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine?
2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine has a molecular weight of 223.67 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,5-dimethylpyrazol-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 22309464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).