N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide

C14H18Cl2N2O2 — CID 47103111

IUPACN-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide
SMILESCC(C(=O)Nc1cccc(Cl)c1Cl)N1CCCC(O)C1
InChIInChI=1S/C14H18Cl2N2O2/c1-9(18-7-3-4-10(19)8-18)14(20)17-12-6-2-5-11(15)13(12)16/h2,5-6,9-10,19H,3-4,7-8H2,1H3,(H,17,20)
InChIKeyGXDOZBSHNWQHMV-UHFFFAOYSA-N
MW317.22 g/mol
LogP2.78
Rot. Bonds3

About N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide

N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide (PubChem CID 47103111) has the molecular formula C14H18Cl2N2O2 and a molecular weight of 317.22 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide
PubChem CID47103111
Molecular FormulaC14H18Cl2N2O2
Molecular Weight317.22 g/mol
Exact Mass316.07
IUPAC NameN-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide
SMILESCC(C(=O)Nc1cccc(Cl)c1Cl)N1CCCC(O)C1
InChIInChI=1S/C14H18Cl2N2O2/c1-9(18-7-3-4-10(19)8-18)14(20)17-12-6-2-5-11(15)13(12)16/h2,5-6,9-10,19H,3-4,7-8H2,1H3,(H,17,20)
InChIKeyGXDOZBSHNWQHMV-UHFFFAOYSA-N
XLogP2.78
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.22
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-(cyclopropylmethyl)-1-[(2S)-1-(2,3-dichloroanilino)-1-oxopropan-2-yl]piperidine-3-carboxamide
CID 94459780
(2S)-N-(2-chlorophenyl)-2-[(3R)-3-methylpiperidin-1-yl]propanamide
CID 9275425
N-(3-chloro-2-methylphenyl)-2-[3-(hydroxymethyl)piperidin-1-yl]propanamide
CID 110880139
N-(2,6-diethylphenyl)-2-(3-hydroxypiperidin-1-yl)propanamide
CID 110884119
N-(2,3-dichlorophenyl)-2-morpholin-4-ylpropanamide
CID 51167813
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(2,3-dichlorophenyl)propanamide
CID 120775712
3-[1-[1-(3-chloro-2-methylanilino)-1-oxopropan-2-yl]piperidin-3-yl]propanoic acid
CID 122101242
(2R)-N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]propanamide
CID 98762896
N-(4-amino-2-methylphenyl)-2-(3-hydroxypiperidin-1-yl)propanamide
CID 43575281
N-(2-aminophenyl)-2-(3-hydroxypyrrolidin-1-yl)propanamide
CID 62942601
methyl 2-[(2S)-4-[(2R)-1-(2,3-dichloroanilino)-1-oxopropan-2-yl]morpholin-2-yl]acetate
CID 98773575
(2S)-N-(3-chloro-2-methylphenyl)-2-[(3R)-3-(1,3-dioxolan-2-yl)piperidin-1-yl]propanamide
CID 100855978

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide (CID 47103111) is N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide is CC(C(=O)Nc1cccc(Cl)c1Cl)N1CCCC(O)C1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide?
The InChIKey is GXDOZBSHNWQHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O2/c1-9(18-7-3-4-10(19)8-18)14(20)17-12-6-2-5-11(15)13(12)16/h2,5-6,9-10,19H,3-4,7-8H2,1H3,(H,17,20).
What are the key properties of N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide?
N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide has a molecular weight of 317.22 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(3-hydroxypiperidin-1-yl)propanamide is sourced from PubChem (CID 47103111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).