2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine

C14H15ClN2 — CID 60819195

IUPAC2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine
SMILESCNC(Cc1ccc(Cl)cc1)c1ccncc1
InChIInChI=1S/C14H15ClN2/c1-16-14(12-6-8-17-9-7-12)10-11-2-4-13(15)5-3-11/h2-9,14,16H,10H2,1H3
InChIKeyWTQGIXZVBZGFSJ-UHFFFAOYSA-N
MW246.74 g/mol
LogP3.24
Rot. Bonds4

About 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine

2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine (PubChem CID 60819195) has the molecular formula C14H15ClN2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine
PubChem CID60819195
Molecular FormulaC14H15ClN2
Molecular Weight246.74 g/mol
Exact Mass246.09
IUPAC Name2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine
SMILESCNC(Cc1ccc(Cl)cc1)c1ccncc1
InChIInChI=1S/C14H15ClN2/c1-16-14(12-6-8-17-9-7-12)10-11-2-4-13(15)5-3-11/h2-9,14,16H,10H2,1H3
InChIKeyWTQGIXZVBZGFSJ-UHFFFAOYSA-N
XLogP3.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-N-methyl-3-pyridin-4-ylpropan-2-amine
CID 62553099
2-(4-chlorophenyl)-1-(3,4-dichlorophenyl)-N-methylethanamine
CID 43486451
1-(4-chlorophenyl)-2-(4-methoxyphenyl)-N-methylethanamine
CID 43481478
2-chloro-N-methyl-1-pyridin-4-ylethanamine
CID 116952687
2-(4-chlorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylethanamine
CID 54967680
1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine
CID 60818995
N-methyl-1-(2-methyl-4-pyridinyl)-2-pyridin-4-ylethanamine
CID 106755506
1-(4-bromo-3-chlorophenyl)-N-methyl-2-pyridin-4-ylethanamine
CID 81294947
1-(4-chlorophenyl)-2-(3,4-dimethylphenyl)-N-methylethanamine
CID 63414512
2-(3-chloro-4-fluorophenyl)-1-(4-chlorophenyl)-N-methylethanamine
CID 103039760
1-(4-chlorophenyl)-N-methyl-2-(4-nitrophenyl)ethanamine
CID 61064293
1-(4-chloro-3-methoxyphenyl)-N-methyl-2-pyridin-4-ylethanamine
CID 79697191

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine?
The IUPAC name of 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine (CID 60819195) is 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine.
What is the SMILES notation for 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine?
The canonical SMILES for 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine is CNC(Cc1ccc(Cl)cc1)c1ccncc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine?
The InChIKey is WTQGIXZVBZGFSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2/c1-16-14(12-6-8-17-9-7-12)10-11-2-4-13(15)5-3-11/h2-9,14,16H,10H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine?
2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine has a molecular weight of 246.74 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-methyl-1-pyridin-4-ylethanamine is sourced from PubChem (CID 60819195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).