N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide

C16H17ClN2O2 — CID 99701809

IUPACN-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide
SMILESC[C@](O)(CNC(=O)Cc1cccnc1)c1ccccc1Cl
InChIInChI=1S/C16H17ClN2O2/c1-16(21,13-6-2-3-7-14(13)17)11-19-15(20)9-12-5-4-8-18-10-12/h2-8,10,21H,9,11H2,1H3,(H,19,20)/t16-/m0/s1
InChIKeyHUQIMAQQTZFTGC-INIZCTEOSA-N
MW304.78 g/mol
LogP2.30
Rot. Bonds5

About N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide

N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide (PubChem CID 99701809) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide
PubChem CID99701809
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide
SMILESC[C@](O)(CNC(=O)Cc1cccnc1)c1ccccc1Cl
InChIInChI=1S/C16H17ClN2O2/c1-16(21,13-6-2-3-7-14(13)17)11-19-15(20)9-12-5-4-8-18-10-12/h2-8,10,21H,9,11H2,1H3,(H,19,20)/t16-/m0/s1
InChIKeyHUQIMAQQTZFTGC-INIZCTEOSA-N
XLogP2.30
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2,4-dimethylpentyl)-2-pyridin-3-ylacetamide
CID 66178919
N-[2-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-carboxamide
CID 75523447
N'-[(2-chlorophenyl)methyl]-N-(pyridin-3-ylmethyl)oxamide
CID 44998655
N-[2-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrrole-2-carboxamide
CID 75508221
2-chloro-N-(pyridin-3-ylmethyl)benzamide
CID 669068
N-[2-(2,6-dichlorophenoxy)ethyl]-2-pyridin-3-ylacetamide
CID 19871620
N-[2-(2-chlorophenyl)-2-hydroxypropyl]-4-cyanobenzamide
CID 86793655
N-(2-methoxyethyl)-2-pyridin-3-ylacetamide
CID 110697049
N-(3-aminobutyl)-2-pyridin-3-ylacetamide
CID 63253983
N-(2-benzyl-3-methylbutyl)-2-pyridin-3-ylacetamide
CID 119045205
N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-1-hydroxycyclopentane-1-carboxamide
CID 99702505
N-[(E)-but-2-enyl]-2-pyridin-3-ylacetamide
CID 178011059

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide (CID 99701809) is N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide is C[C@](O)(CNC(=O)Cc1cccnc1)c1ccccc1Cl.
What is the InChIKey of N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide?
The InChIKey is HUQIMAQQTZFTGC-INIZCTEOSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-16(21,13-6-2-3-7-14(13)17)11-19-15(20)9-12-5-4-8-18-10-12/h2-8,10,21H,9,11H2,1H3,(H,19,20)/t16-/m0/s1.
What are the key properties of N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide?
N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide has a molecular weight of 304.78 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 99701809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).