N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine

C15H19N3 — CID 133299032

IUPACN-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine
SMILESCc1ccc(CCNc2cc(C)ncn2)c(C)c1
InChIInChI=1S/C15H19N3/c1-11-4-5-14(12(2)8-11)6-7-16-15-9-13(3)17-10-18-15/h4-5,8-10H,6-7H2,1-3H3,(H,16,17,18)
InChIKeyIDDTVPJWUFBHRT-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.06
Rot. Bonds4

About N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine

N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine (PubChem CID 133299032) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine
PubChem CID133299032
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine
SMILESCc1ccc(CCNc2cc(C)ncn2)c(C)c1
InChIInChI=1S/C15H19N3/c1-11-4-5-14(12(2)8-11)6-7-16-15-9-13(3)17-10-18-15/h4-5,8-10H,6-7H2,1-3H3,(H,16,17,18)
InChIKeyIDDTVPJWUFBHRT-UHFFFAOYSA-N
XLogP3.06
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-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

N-[2-(2,4-dichlorophenyl)ethyl]-6-methylpyrimidin-4-amine
CID 61224338
5-bromo-N-[2-(2,4-dimethylphenyl)ethyl]pyridin-2-amine
CID 115146816
N',N'-dimethyl-N-(6-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 61225693
[1-[6-[2-(2,4-dimethylphenyl)ethylamino]pyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 133299034
N-(2-bromoethyl)-6-methylpyrimidin-4-amine
CID 126848039
6-methyl-N-[2-(1H-pyrrol-2-yl)ethyl]pyrimidin-4-amine
CID 75483789
N-(3-bromopropyl)-6-methylpyrimidin-4-amine
CID 126848040
4-N-(2,5-dimethylphenyl)-6-N-[2-(2-fluorophenyl)ethyl]pyrimidine-4,6-diamine
CID 112861313
2-(2,4-dimethylphenyl)-N-ethylethanamine
CID 62801673
N-[2-(3,5-dimethylphenoxy)ethyl]-6-methylpyrimidin-4-amine
CID 133298580
4-N-(2,5-dimethylphenyl)-6-N-(2-phenylethyl)pyrimidine-4,6-diamine
CID 112861082
N-(5-methyl-2-pyridinyl)-3-[(6-methylpyrimidin-4-yl)amino]propanamide
CID 133301210

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine?
The IUPAC name of N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine (CID 133299032) is N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine.
What is the SMILES notation for N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine?
The canonical SMILES for N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine is Cc1ccc(CCNc2cc(C)ncn2)c(C)c1.
What is the InChIKey of N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine?
The InChIKey is IDDTVPJWUFBHRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-4-5-14(12(2)8-11)6-7-16-15-9-13(3)17-10-18-15/h4-5,8-10H,6-7H2,1-3H3,(H,16,17,18).
What are the key properties of N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine?
N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dimethylphenyl)ethyl]-6-methylpyrimidin-4-amine is sourced from PubChem (CID 133299032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).