6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine

C18H23N3 — CID 114607003

IUPAC6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(NC)c(C)c(-c2cccc(C3CCC3)c2)n1
InChIInChI=1S/C18H23N3/c1-4-16-20-17(12(2)18(19-3)21-16)15-10-6-9-14(11-15)13-7-5-8-13/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,19,20,21)
InChIKeyJWUISGZNPTWWOG-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.32
Rot. Bonds4

About 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine

6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine (PubChem CID 114607003) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
PubChem CID114607003
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(NC)c(C)c(-c2cccc(C3CCC3)c2)n1
InChIInChI=1S/C18H23N3/c1-4-16-20-17(12(2)18(19-3)21-16)15-10-6-9-14(11-15)13-7-5-8-13/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,19,20,21)
InChIKeyJWUISGZNPTWWOG-UHFFFAOYSA-N
XLogP4.32
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-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-ethyl-N,5-dimethyl-6-(3-methylphenyl)pyrimidin-4-amine
CID 80975057
6-(3-cyclobutylphenyl)-N-ethyl-5-methylpyrimidin-4-amine
CID 114607000
6-(3-cyclobutylphenyl)-N-ethyl-4,5-dimethylpyridazin-3-amine
CID 114607011
6-(3,5-dimethylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80975562
2-(cyclopropylmethyl)-N,5-dimethyl-6-phenylpyrimidin-4-amine
CID 104846775
4-(3-cyclobutylphenyl)-2,5-dimethyl-1H-pyrimidin-6-one
CID 136770360
2-ethyl-N,5-dimethyl-6-naphthalen-1-ylpyrimidin-4-amine
CID 80970250
2-ethyl-5-methyl-6-(3-methylphenyl)-N-propylpyrimidin-4-amine
CID 80975147
1,3-bis(3-cyclopentylphenyl)-2-methylbenzene
CID 162497484
2-ethyl-N,5-dimethyl-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 80975159
6-(3-cyclobutylphenyl)-2-ethyl-5-methyl-1H-pyrimidine-4-thione
CID 106522451
2-ethyl-N,5-dimethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-4-amine
CID 80978807

Frequently Asked Questions

What is the IUPAC name of 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine (CID 114607003) is 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine is CCc1nc(NC)c(C)c(-c2cccc(C3CCC3)c2)n1.
What is the InChIKey of 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The InChIKey is JWUISGZNPTWWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-4-16-20-17(12(2)18(19-3)21-16)15-10-6-9-14(11-15)13-7-5-8-13/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,19,20,21).
What are the key properties of 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine?
6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine has a molecular weight of 281.40 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-cyclobutylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 114607003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).