2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine

C14H16N4 — CID 80975742

IUPAC2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine
SMILESCNc1nc(C2CC2)nc(-c2ccncc2)c1C
InChIInChI=1S/C14H16N4/c1-9-12(10-5-7-16-8-6-10)17-14(11-3-4-11)18-13(9)15-2/h5-8,11H,3-4H2,1-2H3,(H,15,17,18)
InChIKeyOVLVSBHYFCXPGF-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.77
Rot. Bonds3

About 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine

2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine (PubChem CID 80975742) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine
PubChem CID80975742
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC Name2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine
SMILESCNc1nc(C2CC2)nc(-c2ccncc2)c1C
InChIInChI=1S/C14H16N4/c1-9-12(10-5-7-16-8-6-10)17-14(11-3-4-11)18-13(9)15-2/h5-8,11H,3-4H2,1-2H3,(H,15,17,18)
InChIKeyOVLVSBHYFCXPGF-UHFFFAOYSA-N
XLogP2.77
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-N,5-dimethyl-6-(6-methyl-3-pyridinyl)pyrimidin-4-amine
CID 80977389
2-cyclopropyl-6-(4-fluoro-3-methylphenyl)-N,5-dimethylpyrimidin-4-amine
CID 80975820
2-cyclopropyl-N,5-dimethyl-6-pyrazin-2-ylpyrimidin-4-amine
CID 80976398
2-cyclopropyl-6-(3-fluoro-4-methoxyphenyl)-N,5-dimethylpyrimidin-4-amine
CID 80978703
2-cyclopropyl-N-ethyl-5-methyl-6-(3-methyl-4-pyridinyl)pyrimidin-4-amine
CID 80976322
2-cyclopropyl-6-(4-fluorophenyl)sulfanyl-N,5-dimethylpyrimidin-4-amine
CID 80989965
2-cyclopropyl-4-N-(3,4-dimethylphenyl)-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80977442
5-bromo-2-cyclobutyl-N-methyl-6-phenylpyrimidin-4-amine
CID 66294324
2-cyclopropyl-6-N,5-dimethyl-4-N-(thiophen-3-ylmethyl)pyrimidine-4,6-diamine
CID 80985468
2-cyclopropyl-6-(1,3-dihydroisoindol-2-yl)-N,5-dimethylpyrimidin-4-amine
CID 80984983
5-bromo-2-cyclohexyl-N-methyl-6-phenylpyrimidin-4-amine
CID 66294532
4-N-cyclohexyl-2-cyclopropyl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80980958

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine (CID 80975742) is 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine is CNc1nc(C2CC2)nc(-c2ccncc2)c1C.
What is the InChIKey of 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine?
The InChIKey is OVLVSBHYFCXPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c1-9-12(10-5-7-16-8-6-10)17-14(11-3-4-11)18-13(9)15-2/h5-8,11H,3-4H2,1-2H3,(H,15,17,18).
What are the key properties of 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine?
2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine has a molecular weight of 240.31 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N,5-dimethyl-6-pyridin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 80975742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).