N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine

C15H19N5 — CID 43675588

IUPACN-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
SMILESc1cnc(N2CCC(NCc3ccncc3)CC2)nc1
InChIInChI=1S/C15H19N5/c1-6-17-15(18-7-1)20-10-4-14(5-11-20)19-12-13-2-8-16-9-3-13/h1-3,6-9,14,19H,4-5,10-12H2
InChIKeyQHGUVGIHLCLXKN-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.63
Rot. Bonds4

About N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine

N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine (PubChem CID 43675588) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
PubChem CID43675588
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC NameN-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
SMILESc1cnc(N2CCC(NCc3ccncc3)CC2)nc1
InChIInChI=1S/C15H19N5/c1-6-17-15(18-7-1)20-10-4-14(5-11-20)19-12-13-2-8-16-9-3-13/h1-3,6-9,14,19H,4-5,10-12H2
InChIKeyQHGUVGIHLCLXKN-UHFFFAOYSA-N
XLogP1.63
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-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

4-[[(1-pyrimidin-2-ylpiperidin-4-yl)amino]methyl]benzenesulfonamide
CID 72848257
N-(pyridin-4-ylmethyl)cyclooctanamine
CID 4722994
N-(pyrazin-2-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 62761801
1-tert-butyl-N-(pyridin-4-ylmethyl)piperidin-4-amine
CID 51085983
N-[(5-bromofuran-2-yl)methyl]-1-pyrimidin-2-ylpiperidin-4-amine
CID 43675593
N-(2-pyridin-3-ylethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 72912791
N-[(5-iodofuran-2-yl)methyl]-1-pyrimidin-2-ylpiperidin-4-amine
CID 43779441
4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide
CID 43769393
2-[4-(4-pyridin-4-ylbutyl)piperidin-1-yl]pyrimidine
CID 59865110
N-[(1-methyltriazol-4-yl)methyl]-1-pyrimidin-2-ylpiperidin-4-amine
CID 62757757
N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 119126767
N-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 56795837

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine?
The IUPAC name of N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine (CID 43675588) is N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine.
What is the SMILES notation for N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine?
The canonical SMILES for N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine is c1cnc(N2CCC(NCc3ccncc3)CC2)nc1.
What is the InChIKey of N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine?
The InChIKey is QHGUVGIHLCLXKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-6-17-15(18-7-1)20-10-4-14(5-11-20)19-12-13-2-8-16-9-3-13/h1-3,6-9,14,19H,4-5,10-12H2.
What are the key properties of N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine?
N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine has a molecular weight of 269.35 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine is sourced from PubChem (CID 43675588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).