1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine

C24H26N2 — CID 143153329

IUPAC1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine
SMILESCc1cccc(C2=NCCCN2C)c1CCc1cccc2ccccc12
InChIInChI=1S/C24H26N2/c1-18-8-5-13-23(24-25-16-7-17-26(24)2)21(18)15-14-20-11-6-10-19-9-3-4-12-22(19)20/h3-6,8-13H,7,14-17H2,1-2H3
InChIKeyORYZONAJJVSOEZ-UHFFFAOYSA-N
MW342.49 g/mol
LogP5.02
Rot. Bonds4

About 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine

1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine (PubChem CID 143153329) has the molecular formula C24H26N2 and a molecular weight of 342.49 g/mol. Its IUPAC name is 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine.

Molecular Properties

Compound Name1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine
PubChem CID143153329
Molecular FormulaC24H26N2
Molecular Weight342.49 g/mol
Exact Mass342.21
IUPAC Name1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine
SMILESCc1cccc(C2=NCCCN2C)c1CCc1cccc2ccccc12
InChIInChI=1S/C24H26N2/c1-18-8-5-13-23(24-25-16-7-17-26(24)2)21(18)15-14-20-11-6-10-19-9-3-4-12-22(19)20/h3-6,8-13H,7,14-17H2,1-2H3
InChIKeyORYZONAJJVSOEZ-UHFFFAOYSA-N
XLogP5.02
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.49
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine 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

3-[2-[2-(2-naphthalen-1-ylethyl)phenyl]-4,5-dihydroimidazol-1-yl]pentanenitrile
CID 59715253
2-[3-chloro-2-(2-naphthalen-1-ylethyl)phenyl]-1,4,5,6-tetrahydropyrimidine;hydrochloride
CID 69239082
3-[2-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]propanal
CID 117308217
5-(1-methyl-4,5-dihydroimidazol-2-yl)-6-(2-naphthalen-1-ylethyl)cyclohexa-2,4-dien-1-ol
CID 143152975
2-[2-[2-(3-bromonaphthalen-1-yl)ethyl]-3-fluorophenyl]-1-propan-2-yl-4,5-dihydroimidazole
CID 59715360
3-(2-naphthalen-1-ylethyl)-2-(1-propan-2-yl-4,5-dihydroimidazol-2-yl)pyridine
CID 11709917
ethane;3-(2-naphthalen-1-ylethyl)-2-(1,4,5,6-tetrahydropyrimidin-2-yl)aniline
CID 143153163
7-(2-methylphenyl)-3-(4-naphthalen-1-ylbutyl)-1H-indole-2-carboxylic acid
CID 68937222
N-(2-naphthalen-1-ylethyl)-1,4,5,6-tetrahydropyrimidin-2-amine
CID 110915371
2-(2-naphthalen-1-ylethyl)-4,5-dihydro-1H-imidazole;hydrochloride
CID 3086490
methanamine;1-propylnaphthalene
CID 174438724
2-[(Z)-2-(2-methoxynaphthalen-1-yl)ethenyl]-1-methyl-5,6-dihydro-4H-pyrimidine
CID 10446399

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine?
The IUPAC name of 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine (CID 143153329) is 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine.
What is the SMILES notation for 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine?
The canonical SMILES for 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine is Cc1cccc(C2=NCCCN2C)c1CCc1cccc2ccccc12.
What is the InChIKey of 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine?
The InChIKey is ORYZONAJJVSOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2/c1-18-8-5-13-23(24-25-16-7-17-26(24)2)21(18)15-14-20-11-6-10-19-9-3-4-12-22(19)20/h3-6,8-13H,7,14-17H2,1-2H3.
What are the key properties of 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine?
1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine has a molecular weight of 342.49 g/mol, XLogP of 5.02, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[3-methyl-2-(2-naphthalen-1-ylethyl)phenyl]-5,6-dihydro-4H-pyrimidine is sourced from PubChem (CID 143153329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).