[4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol

C15H19N3O — CID 83184450

IUPAC[4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol
SMILESCc1ccccc1CN(C)c1ncc(CO)c(C)n1
InChIInChI=1S/C15H19N3O/c1-11-6-4-5-7-13(11)9-18(3)15-16-8-14(10-19)12(2)17-15/h4-8,19H,9-10H2,1-3H3
InChIKeyQIGUBCLBBMBWQX-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.22
Rot. Bonds4

About [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol

[4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol (PubChem CID 83184450) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol
PubChem CID83184450
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name[4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol
SMILESCc1ccccc1CN(C)c1ncc(CO)c(C)n1
InChIInChI=1S/C15H19N3O/c1-11-6-4-5-7-13(11)9-18(3)15-16-8-14(10-19)12(2)17-15/h4-8,19H,9-10H2,1-3H3
InChIKeyQIGUBCLBBMBWQX-UHFFFAOYSA-N
XLogP2.22
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol 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-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol
CID 83184280
5-(chloromethyl)-N-[(2-chlorophenyl)methyl]-N,4-dimethylpyrimidin-2-amine
CID 83184319
5-(chloromethyl)-N-[(2-fluorophenyl)methyl]-N,4-dimethylpyrimidin-2-amine
CID 83184048
[2-[(4-bromothiophen-2-yl)methyl-methylamino]-4-methylpyrimidin-5-yl]methanol
CID 83183767
[2-(2-fluoro-N-methylanilino)-4-methylpyrimidin-5-yl]methanol
CID 83184712
2-[benzyl-[5-(hydroxymethyl)-4-methylpyrimidin-2-yl]amino]ethanol
CID 83183770
[2-(diethylamino)-4-methylpyrimidin-5-yl]methanol
CID 83183758
[2-[1-(2-fluorophenyl)ethyl-methylamino]-4-methylpyrimidin-5-yl]methanol
CID 83184020
[5-[methyl-[(2-methylphenyl)methyl]amino]-2-propan-2-ylpyrimidin-4-yl]methanol
CID 62088677
[2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol
CID 61411894
[2-[(dimethylamino)methyl]-4-methylpyrimidin-5-yl]methanol
CID 130482956
[2-[ethyl(propan-2-yl)amino]-4-methylpyrimidin-5-yl]methanol
CID 83184884

Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol?
The IUPAC name of [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol (CID 83184450) is [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol.
What is the SMILES notation for [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol?
The canonical SMILES for [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol is Cc1ccccc1CN(C)c1ncc(CO)c(C)n1.
What is the InChIKey of [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol?
The InChIKey is QIGUBCLBBMBWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-11-6-4-5-7-13(11)9-18(3)15-16-8-14(10-19)12(2)17-15/h4-8,19H,9-10H2,1-3H3.
What are the key properties of [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol?
[4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol has a molecular weight of 257.34 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]pyrimidin-5-yl]methanol is sourced from PubChem (CID 83184450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).