2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine

C12H17N5 — CID 103570486

IUPAC2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1ccnc(-c2cnn(CC)c2)n1
InChIInChI=1S/C12H17N5/c1-3-6-13-11-5-7-14-12(16-11)10-8-15-17(4-2)9-10/h5,7-9H,3-4,6H2,1-2H3,(H,13,14,16)
InChIKeyAZJZEEWEUSYNJL-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.18
Rot. Bonds5

About 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine

2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine (PubChem CID 103570486) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine
PubChem CID103570486
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1ccnc(-c2cnn(CC)c2)n1
InChIInChI=1S/C12H17N5/c1-3-6-13-11-5-7-14-12(16-11)10-8-15-17(4-2)9-10/h5,7-9H,3-4,6H2,1-2H3,(H,13,14,16)
InChIKeyAZJZEEWEUSYNJL-UHFFFAOYSA-N
XLogP2.18
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-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-(1-ethylpyrazol-4-yl)-N-methylpyrimidin-4-amine
CID 103570484
2-(4-methoxyphenyl)-N-propylpyrimidin-4-amine
CID 62191848
2-(4-bromo-3,5-dimethylphenyl)-N-propylpyrimidin-4-amine
CID 114330961
N-propyl-2-(2-propylpyrazol-3-yl)pyrimidin-4-amine
CID 114557298
2-naphthalen-2-yl-N-propylpyrimidin-4-amine
CID 62202615
2-(3-bromophenyl)-N-propylpyrimidin-4-amine
CID 55135437
5-bromo-2-(1-ethylpyrazol-4-yl)-6-methyl-N-propylpyrimidin-4-amine
CID 103570523
2-(5-fluoro-2-pyridinyl)-N-propylpyrimidin-4-amine
CID 79717957
N-propyl-2-(2,4,6-trimethylphenyl)pyrimidin-4-amine
CID 62201721
2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine
CID 62203140
2-(3-bromofuran-2-yl)-N-propylpyrimidin-4-amine
CID 106889197
2-(5-methylfuran-2-yl)-N-propylpyrimidin-4-amine
CID 62203835

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine (CID 103570486) is 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine is CCCNc1ccnc(-c2cnn(CC)c2)n1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine?
The InChIKey is AZJZEEWEUSYNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-3-6-13-11-5-7-14-12(16-11)10-8-15-17(4-2)9-10/h5,7-9H,3-4,6H2,1-2H3,(H,13,14,16).
What are the key properties of 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine?
2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine has a molecular weight of 231.30 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 103570486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).