(1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine

C12H14N4 — CID 81407076

IUPAC(1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine
SMILESC[C@@H](NCc1ncccn1)c1ccccn1
InChIInChI=1S/C12H14N4/c1-10(11-5-2-3-6-13-11)16-9-12-14-7-4-8-15-12/h2-8,10,16H,9H2,1H3/t10-/m1/s1
InChIKeyJRRDHNZZAGUQBN-SNVBAGLBSA-N
MW214.27 g/mol
LogP1.72
Rot. Bonds4

About (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine

(1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine (PubChem CID 81407076) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name(1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine
PubChem CID81407076
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name(1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine
SMILESC[C@@H](NCc1ncccn1)c1ccccn1
InChIInChI=1S/C12H14N4/c1-10(11-5-2-3-6-13-11)16-9-12-14-7-4-8-15-12/h2-8,10,16H,9H2,1H3/t10-/m1/s1
InChIKeyJRRDHNZZAGUQBN-SNVBAGLBSA-N
XLogP1.72
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine 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

(1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine
CID 81401879
(1R)-N-[(2-methyltetrazol-5-yl)methyl]-1-pyridin-2-ylethanamine
CID 107042590
(1S)-N-[(2-methyltetrazol-5-yl)methyl]-1-pyridin-2-ylethanamine
CID 107042589
N-[(1S)-1-pyridin-2-ylethyl]but-2-yn-1-amine
CID 81402313
(1R)-N-[(2-phenylphenyl)methyl]-1-pyridin-2-ylethanamine
CID 69062118
(1R)-1-pyridin-2-yl-N-(pyrimidin-5-ylmethyl)ethanamine
CID 81402120
2-[[[(1R)-1-pyridin-2-ylethyl]amino]methyl]benzonitrile
CID 93034581
N-[(2-methylquinolin-4-yl)methyl]-1-pyridin-2-ylethanamine
CID 78943042
2-[[(1R)-1-pyridin-2-ylethyl]amino]acetonitrile
CID 81407753
N-(1,2-oxazol-5-ylmethyl)-1-pyridin-2-ylethanamine
CID 103605434
1-pyridin-2-yl-N-[(2,4,6-trimethylphenyl)methyl]ethanamine
CID 43181287
(1S)-1-pyridin-2-yl-N-[(4-trimethylsilylphenyl)methyl]ethanamine
CID 103437978

Frequently Asked Questions

What is the IUPAC name of (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine?
The IUPAC name of (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine (CID 81407076) is (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine.
What is the SMILES notation for (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine?
The canonical SMILES for (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine is C[C@@H](NCc1ncccn1)c1ccccn1.
What is the InChIKey of (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine?
The InChIKey is JRRDHNZZAGUQBN-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H14N4/c1-10(11-5-2-3-6-13-11)16-9-12-14-7-4-8-15-12/h2-8,10,16H,9H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine?
(1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine has a molecular weight of 214.27 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 81407076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).