2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine

C9H11N5 — CID 131141065

IUPAC2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine
SMILESNc1ccnc(CCn2cccn2)n1
InChIInChI=1S/C9H11N5/c10-8-2-5-11-9(13-8)3-7-14-6-1-4-12-14/h1-2,4-6H,3,7H2,(H2,10,11,13)
InChIKeyKCHJSLUWFYZKAI-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.50
Rot. Bonds3

About 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine

2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine (PubChem CID 131141065) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine
PubChem CID131141065
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC Name2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine
SMILESNc1ccnc(CCn2cccn2)n1
InChIInChI=1S/C9H11N5/c10-8-2-5-11-9(13-8)3-7-14-6-1-4-12-14/h1-2,4-6H,3,7H2,(H2,10,11,13)
InChIKeyKCHJSLUWFYZKAI-UHFFFAOYSA-N
XLogP0.50
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N-(2-pyrazol-1-ylethyl)pyrimidine-2,4-diamine
CID 115978219
3-(2-pyrazol-1-ylethyl)-1,2,4-oxadiazol-5-amine
CID 131052628
3-(2-pyrazol-1-ylethyl)imidazo[4,5-b]pyridin-2-amine
CID 79289514
6-amino-2-(2-pyrazol-1-ylethyl)pyridazin-3-one
CID 116788167
2-[(1-ethylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 116795282
4-(4-aminopyrimidin-2-yl)butanoic acid
CID 68768286
2-(10-methylundecyl)pyrimidin-4-amine
CID 58722363
6-fluoro-1-(2-pyrazol-1-ylethyl)benzimidazol-2-amine
CID 62378399
6-amino-N-(2-pyrazol-1-ylethyl)pyridine-2-carboxamide
CID 62239354
5-methyl-1-(2-pyrazol-1-ylethyl)benzimidazol-2-amine
CID 54951144
2-pyrazol-1-ylpyrimidin-4-amine;hydrate;dihydrochloride
CID 175006544
2-[(4-ethylphenyl)methyl]pyrimidin-4-amine
CID 82284409

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine?
The IUPAC name of 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine (CID 131141065) is 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine?
The canonical SMILES for 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine is Nc1ccnc(CCn2cccn2)n1.
What is the InChIKey of 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine?
The InChIKey is KCHJSLUWFYZKAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c10-8-2-5-11-9(13-8)3-7-14-6-1-4-12-14/h1-2,4-6H,3,7H2,(H2,10,11,13).
What are the key properties of 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine?
2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine has a molecular weight of 189.22 g/mol, XLogP of 0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine is sourced from PubChem (CID 131141065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).