(2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine

C17H21ClN2 — CID 165410342

IUPAC(2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine
SMILESCNC[C@H](Cc1ncccc1C)c1cc(Cl)ccc1C
InChIInChI=1S/C17H21ClN2/c1-12-6-7-15(18)10-16(12)14(11-19-3)9-17-13(2)5-4-8-20-17/h4-8,10,14,19H,9,11H2,1-3H3/t14-/m0/s1
InChIKeyZKKUNDDCAMSBGH-AWEZNQCLSA-N
MW288.82 g/mol
LogP3.90
Rot. Bonds5

About (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine

(2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine (PubChem CID 165410342) has the molecular formula C17H21ClN2 and a molecular weight of 288.82 g/mol. Its IUPAC name is (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine.

Molecular Properties

Compound Name(2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine
PubChem CID165410342
Molecular FormulaC17H21ClN2
Molecular Weight288.82 g/mol
Exact Mass288.14
IUPAC Name(2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine
SMILESCNC[C@H](Cc1ncccc1C)c1cc(Cl)ccc1C
InChIInChI=1S/C17H21ClN2/c1-12-6-7-15(18)10-16(12)14(11-19-3)9-17-13(2)5-4-8-20-17/h4-8,10,14,19H,9,11H2,1-3H3/t14-/m0/s1
InChIKeyZKKUNDDCAMSBGH-AWEZNQCLSA-N
XLogP3.90
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.82
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-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

(2R)-2-(4-chloro-2-methylphenyl)-3-(3-ethyl-2-pyridinyl)-N-methylpropan-1-amine
CID 167169233
2-(4-chloro-2-iodophenyl)-3-[3-(iodomethyl)-2-pyridinyl]-N-methylpropan-1-amine
CID 165410548
2-[2-(5-chloro-2-methylphenyl)ethyl]-3-methylpyridine;N-methylethanamine
CID 165410059
1-(2-bromo-5-chlorophenyl)-2-(3-methyl-2-pyridinyl)ethanamine
CID 114027773
2-[2-(2-bromo-4-chlorophenyl)-2-chloroethyl]-3-methylpyridine
CID 107995639
3-(3-chloro-4-fluorophenyl)-N-methyl-2-(2-methylphenyl)propan-1-amine
CID 103041125
1-[5-chloro-2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanol
CID 112650649
1-(3,4-dichlorophenyl)-N-methyl-2-(3-methyl-2-pyridinyl)ethanamine
CID 66446677
3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine
CID 165410451
2-[2-chloro-2-(3-chloro-4-methylphenyl)ethyl]-3-methylpyridine
CID 66458987
2-[2-chloro-2-(2-chlorofuran-3-yl)ethyl]-3-methylpyridine
CID 106690733
(2R)-3-(2-chloro-6-methylphenyl)-N-methyl-2-(3-methyl-2-pyridinyl)propan-1-amine
CID 167169300

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine?
The IUPAC name of (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine (CID 165410342) is (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine.
What is the SMILES notation for (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine?
The canonical SMILES for (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine is CNC[C@H](Cc1ncccc1C)c1cc(Cl)ccc1C.
What is the InChIKey of (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine?
The InChIKey is ZKKUNDDCAMSBGH-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H21ClN2/c1-12-6-7-15(18)10-16(12)14(11-19-3)9-17-13(2)5-4-8-20-17/h4-8,10,14,19H,9,11H2,1-3H3/t14-/m0/s1.
What are the key properties of (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine?
(2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine has a molecular weight of 288.82 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(5-chloro-2-methylphenyl)-N-methyl-3-(3-methyl-2-pyridinyl)propan-1-amine is sourced from PubChem (CID 165410342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).