6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine

C15H15N5 — CID 151158667

IUPAC6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine
SMILESCc1cccc(-c2cc(Nc3ccn(C)n3)ncn2)c1
InChIInChI=1S/C15H15N5/c1-11-4-3-5-12(8-11)13-9-15(17-10-16-13)18-14-6-7-20(2)19-14/h3-10H,1-2H3,(H,16,17,18,19)
InChIKeyMZUHBRMFRGNTDP-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.93
Rot. Bonds3

About 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine

6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine (PubChem CID 151158667) has the molecular formula C15H15N5 and a molecular weight of 265.32 g/mol. Its IUPAC name is 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine
PubChem CID151158667
Molecular FormulaC15H15N5
Molecular Weight265.32 g/mol
Exact Mass265.13
IUPAC Name6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine
SMILESCc1cccc(-c2cc(Nc3ccn(C)n3)ncn2)c1
InChIInChI=1S/C15H15N5/c1-11-4-3-5-12(8-11)13-9-15(17-10-16-13)18-14-6-7-20(2)19-14/h3-10H,1-2H3,(H,16,17,18,19)
InChIKeyMZUHBRMFRGNTDP-UHFFFAOYSA-N
XLogP2.93
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine?
The IUPAC name of 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine (CID 151158667) is 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine?
The canonical SMILES for 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine is Cc1cccc(-c2cc(Nc3ccn(C)n3)ncn2)c1.
What is the InChIKey of 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine?
The InChIKey is MZUHBRMFRGNTDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5/c1-11-4-3-5-12(8-11)13-9-15(17-10-16-13)18-14-6-7-20(2)19-14/h3-10H,1-2H3,(H,16,17,18,19).
What are the key properties of 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine?
6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine has a molecular weight of 265.32 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methylphenyl)-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 151158667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).