4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine

C16H20N4 — CID 79918295

IUPAC4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine
SMILESNc1cncnc1N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C16H20N4/c17-15-11-18-12-19-16(15)20-8-6-14(7-9-20)10-13-4-2-1-3-5-13/h1-5,11-12,14H,6-10,17H2
InChIKeyGQASHIWHUGOLEN-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.52
Rot. Bonds3

About 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine

4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine (PubChem CID 79918295) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine.

Molecular Properties

Compound Name4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine
PubChem CID79918295
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine
SMILESNc1cncnc1N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C16H20N4/c17-15-11-18-12-19-16(15)20-8-6-14(7-9-20)10-13-4-2-1-3-5-13/h1-5,11-12,14H,6-10,17H2
InChIKeyGQASHIWHUGOLEN-UHFFFAOYSA-N
XLogP2.52
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(4-benzylpiperidin-1-yl)pyrimidin-5-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

4-(4-benzylpiperidin-1-yl)-6-morpholin-4-ylpyrimidin-5-amine
CID 19137622
4-(4-benzylpiperidin-1-yl)quinazoline
CID 1413843
6-(4-benzylpiperidin-1-yl)-5-bromopyridin-3-amine
CID 79530696
4-(4-benzylpiperidin-1-yl)-6-phenoxypyrimidin-5-amine
CID 19139509
2-(4-benzylpiperidin-1-yl)-6-chloropyridin-3-amine
CID 115473666
4-(4-benzylpiperidin-1-yl)-6-(2,2-diphenylhydrazinyl)pyrimidin-5-amine
CID 19139445
6-(4-benzylpiperidin-1-yl)-4-N-(4-ethylphenyl)pyrimidine-4,5-diamine
CID 22544274
3-(4-benzylpiperidin-1-yl)-5-(trifluoromethyl)pyridin-2-amine
CID 28818263
4-(4-benzylpiperidin-1-yl)-6-methyl-5-phenylthieno[2,3-d]pyrimidine
CID 2132383
4-(4-benzylpiperidin-1-yl)-1-(4-fluorophenyl)pyrazolo[5,4-d]pyrimidine
CID 7205389
4-(4-benzylpiperidin-1-yl)-5,7-diphenylpyrrolo[2,3-d]pyrimidine
CID 4125578
[6-(4-benzylpiperidin-1-yl)pyrazin-2-yl]methanamine
CID 66456001

Frequently Asked Questions

What is the IUPAC name of 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine?
The IUPAC name of 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine (CID 79918295) is 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine.
What is the SMILES notation for 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine?
The canonical SMILES for 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine is Nc1cncnc1N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine?
The InChIKey is GQASHIWHUGOLEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c17-15-11-18-12-19-16(15)20-8-6-14(7-9-20)10-13-4-2-1-3-5-13/h1-5,11-12,14H,6-10,17H2.
What are the key properties of 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine?
4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine has a molecular weight of 268.36 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine is sourced from PubChem (CID 79918295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).