2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol

C14H15ClN2O — CID 170893413

IUPAC2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol
SMILESNC(CO)Cc1cccc(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C14H15ClN2O/c15-11-6-4-10(5-7-11)14-3-1-2-13(17-14)8-12(16)9-18/h1-7,12,18H,8-9,16H2
InChIKeyJUJPUOPAKRRNBY-UHFFFAOYSA-N
MW262.74 g/mol
LogP2.26
Rot. Bonds4

About 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol

2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol (PubChem CID 170893413) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol
PubChem CID170893413
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol
SMILESNC(CO)Cc1cccc(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C14H15ClN2O/c15-11-6-4-10(5-7-11)14-3-1-2-13(17-14)8-12(16)9-18/h1-7,12,18H,8-9,16H2
InChIKeyJUJPUOPAKRRNBY-UHFFFAOYSA-N
XLogP2.26
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(4-chlorophenyl)-2-pyridinyl]butan-2-amine
CID 170889254
2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine
CID 83713592
methyl 3-[6-(2-amino-3-hydroxypropyl)-2-pyridinyl]benzoate;hydrochloride
CID 170893443
2-amino-3-(6-methyl-2-pyridinyl)propan-1-ol;hydrochloride
CID 170891881
1-[6-(4-methylsulfonylphenyl)-2-pyridinyl]butan-2-amine
CID 170889290
2-amino-3-(2,6-dichlorophenyl)propan-1-ol
CID 18387991
2-amino-3-pyridin-2-ylpropan-1-ol;hydrochloride
CID 75525879
[2-chloro-6-(4-chlorophenyl)-3-pyridinyl]methanamine;hydrochloride
CID 117071690
3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methylpropan-1-ol
CID 82123236
[6-(4-tert-butylphenyl)-2-pyridinyl]methanol
CID 22566603
(2S)-2-amino-3-(2-chloro-6-fluorophenyl)propan-1-ol
CID 28804612
(2S)-2-amino-3-pyrimidin-4-ylpropan-1-ol
CID 97304087

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol?
The IUPAC name of 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol (CID 170893413) is 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol.
What is the SMILES notation for 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol?
The canonical SMILES for 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol is NC(CO)Cc1cccc(-c2ccc(Cl)cc2)n1.
What is the InChIKey of 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol?
The InChIKey is JUJPUOPAKRRNBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c15-11-6-4-10(5-7-11)14-3-1-2-13(17-14)8-12(16)9-18/h1-7,12,18H,8-9,16H2.
What are the key properties of 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol?
2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol has a molecular weight of 262.74 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-[6-(4-chlorophenyl)-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 170893413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).