3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine

C14H15ClN2 — CID 83825270

IUPAC3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine
SMILESNCC(Cc1cccc(Cl)c1)c1cccnc1
InChIInChI=1S/C14H15ClN2/c15-14-5-1-3-11(8-14)7-13(9-16)12-4-2-6-17-10-12/h1-6,8,10,13H,7,9,16H2
InChIKeyBBUYCOHACITHQQ-UHFFFAOYSA-N
MW246.74 g/mol
LogP3.02
Rot. Bonds4

About 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine

3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine (PubChem CID 83825270) has the molecular formula C14H15ClN2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine.

Molecular Properties

Compound Name3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine
PubChem CID83825270
Molecular FormulaC14H15ClN2
Molecular Weight246.74 g/mol
Exact Mass246.09
IUPAC Name3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine
SMILESNCC(Cc1cccc(Cl)c1)c1cccnc1
InChIInChI=1S/C14H15ClN2/c15-14-5-1-3-11(8-14)7-13(9-16)12-4-2-6-17-10-12/h1-6,8,10,13H,7,9,16H2
InChIKeyBBUYCOHACITHQQ-UHFFFAOYSA-N
XLogP3.02
TPSA38.91 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 ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-chloro-2-(3-chlorophenyl)ethyl]pyridine
CID 63016855
3-[1-bromo-2-(3-chlorophenyl)ethyl]pyridine
CID 63018759
4-[1-amino-3-(3-chlorophenyl)propan-2-yl]phenol
CID 83975370
3-(3-chlorophenyl)-2-(3-ethoxyphenyl)propan-1-amine
CID 83973269
2-(3,4-dimethylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 83972735
2-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]-1-pyridin-3-ylethanamine
CID 21156761
(5-chloro-2-fluorophenyl)-pyridin-3-ylmethanamine
CID 114885982
2-(3-chlorophenyl)-1-pyrazin-2-ylethanamine
CID 60818285
3-(3-chlorophenyl)-2-(2,4-dimethylphenyl)propan-1-amine
CID 83972824
2-(6-chloro-1-methylindol-3-yl)-3-(3-chlorophenyl)propan-1-amine
CID 83976836
(3R)-3-(3,4-dichlorophenyl)-4-pyridin-3-ylbutan-1-amine
CID 118689235
(E)-1-(4-chlorophenyl)-2-[(3-chlorophenyl)methyl]-3-pyridin-3-ylprop-1-ene-1,3-diol
CID 143201409

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine?
The IUPAC name of 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine (CID 83825270) is 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine.
What is the SMILES notation for 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine?
The canonical SMILES for 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine is NCC(Cc1cccc(Cl)c1)c1cccnc1.
What is the InChIKey of 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine?
The InChIKey is BBUYCOHACITHQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2/c15-14-5-1-3-11(8-14)7-13(9-16)12-4-2-6-17-10-12/h1-6,8,10,13H,7,9,16H2.
What are the key properties of 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine?
3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine has a molecular weight of 246.74 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-2-pyridin-3-ylpropan-1-amine is sourced from PubChem (CID 83825270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).