5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine

C15H19N3 — CID 63208033

IUPAC5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine
SMILESCc1cnc(NCc2ccc(C(C)C)cc2)nc1
InChIInChI=1S/C15H19N3/c1-11(2)14-6-4-13(5-7-14)10-18-15-16-8-12(3)9-17-15/h4-9,11H,10H2,1-3H3,(H,16,17,18)
InChIKeyHDYAODNVLXPZIL-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.52
Rot. Bonds4

About 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine

5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine (PubChem CID 63208033) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine
PubChem CID63208033
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine
SMILESCc1cnc(NCc2ccc(C(C)C)cc2)nc1
InChIInChI=1S/C15H19N3/c1-11(2)14-6-4-13(5-7-14)10-18-15-16-8-12(3)9-17-15/h4-9,11H,10H2,1-3H3,(H,16,17,18)
InChIKeyHDYAODNVLXPZIL-UHFFFAOYSA-N
XLogP3.52
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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-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-[(4-propan-2-ylphenyl)methyl]quinazolin-2-amine
CID 114789025
4-[[(5-methylpyrimidin-2-yl)amino]methyl]benzoic acid
CID 55163403
5-chloro-2-N-ethyl-4-N-[(4-propan-2-ylphenyl)methyl]pyrimidine-2,4-diamine
CID 80792892
5-bromo-N-[(4-methylphenyl)methyl]pyrimidin-2-amine
CID 63873584
5-fluoro-2-hydrazinyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-4-amine
CID 80902838
3-N,5-N-bis[(4-propan-2-ylphenyl)methyl]-1H-1,2,4-triazole-3,5-diamine
CID 7325539
2-(benzylamino)-N-(4-propan-2-ylphenyl)pyrimidine-5-carboxamide
CID 109255447
N-[1-[4-(aminomethyl)phenyl]ethyl]-5-methylpyrimidin-2-amine
CID 63208616
4,6-dimethoxy-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine
CID 115355071
6-methylsulfonyl-N-[(4-propan-2-ylphenyl)methyl]pyridin-3-amine
CID 43675225
4-ethoxy-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine
CID 115974875
5-methyl-3-N-[(4-propan-2-ylphenyl)methyl]benzene-1,3-diamine
CID 112647602

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine?
The IUPAC name of 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine (CID 63208033) is 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine.
What is the SMILES notation for 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine?
The canonical SMILES for 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine is Cc1cnc(NCc2ccc(C(C)C)cc2)nc1.
What is the InChIKey of 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine?
The InChIKey is HDYAODNVLXPZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11(2)14-6-4-13(5-7-14)10-18-15-16-8-12(3)9-17-15/h4-9,11H,10H2,1-3H3,(H,16,17,18).
What are the key properties of 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine?
5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine has a molecular weight of 241.34 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(4-propan-2-ylphenyl)methyl]pyrimidin-2-amine is sourced from PubChem (CID 63208033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).