(1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine

C15H17ClN2 — CID 79691249

IUPAC(1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine
SMILESCC(N[C@H](C)c1cccnc1)c1ccccc1Cl
InChIInChI=1S/C15H17ClN2/c1-11(13-6-5-9-17-10-13)18-12(2)14-7-3-4-8-15(14)16/h3-12,18H,1-2H3/t11-,12?/m1/s1
InChIKeySLTRCVUBVMYHKJ-JHJMLUEUSA-N
MW260.77 g/mol
LogP4.15
Rot. Bonds4

About (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine

(1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine (PubChem CID 79691249) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name(1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine
PubChem CID79691249
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name(1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine
SMILESCC(N[C@H](C)c1cccnc1)c1ccccc1Cl
InChIInChI=1S/C15H17ClN2/c1-11(13-6-5-9-17-10-13)18-12(2)14-7-3-4-8-15(14)16/h3-12,18H,1-2H3/t11-,12?/m1/s1
InChIKeySLTRCVUBVMYHKJ-JHJMLUEUSA-N
XLogP4.15
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine 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-[1-(2-chloro-4-fluorophenyl)ethyl]-1-pyridin-3-ylethanamine
CID 43768143
N-[1-(2,4-dichlorophenyl)ethyl]-1-pyridin-3-ylethanamine
CID 43193785
2-[1-[[(1R)-1-pyridin-3-ylethyl]amino]ethyl]phenol
CID 81407326
(1S)-1-phenyl-N-[(1S)-1-pyridin-3-ylethyl]ethanamine
CID 11413502
(1R)-1-(4-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]ethanamine
CID 81355519
1-(3-chloro-4-fluorophenyl)-N-[(1S)-1-pyridin-3-ylethyl]ethanamine
CID 81344921
(1S)-N-[1-(2,5-dimethylphenyl)ethyl]-1-pyridin-3-ylethanamine
CID 81344166
1-(4-fluorophenyl)-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
CID 81406480
1-(4-bromophenyl)-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
CID 79690838
(1R)-N-[1-(2-chlorophenyl)ethyl]-1-(4-fluorophenyl)ethanamine
CID 81350627
1-(4-iodophenyl)-N-[(1S)-1-pyridin-3-ylethyl]ethanamine
CID 81345023
(1R)-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-1-pyridin-3-ylethanamine
CID 81407144

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine?
The IUPAC name of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine (CID 79691249) is (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine.
What is the SMILES notation for (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine?
The canonical SMILES for (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine is CC(N[C@H](C)c1cccnc1)c1ccccc1Cl.
What is the InChIKey of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine?
The InChIKey is SLTRCVUBVMYHKJ-JHJMLUEUSA-N. The full InChI is InChI=1S/C15H17ClN2/c1-11(13-6-5-9-17-10-13)18-12(2)14-7-3-4-8-15(14)16/h3-12,18H,1-2H3/t11-,12?/m1/s1.
What are the key properties of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine?
(1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine has a molecular weight of 260.77 g/mol, XLogP of 4.15, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[1-(2-chlorophenyl)ethyl]-1-pyridin-3-ylethanamine is sourced from PubChem (CID 79691249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).