N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide

C15H19Cl2NO2 — CID 110015514

IUPACN-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide
SMILESCC(C)(NC(=O)C1CCCC1O)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C15H19Cl2NO2/c1-15(2,9-6-7-11(16)12(17)8-9)18-14(20)10-4-3-5-13(10)19/h6-8,10,13,19H,3-5H2,1-2H3,(H,18,20)
InChIKeyPAURSWYTCRWAGS-UHFFFAOYSA-N
MW316.23 g/mol
LogP3.51
Rot. Bonds3

About N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide

N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide (PubChem CID 110015514) has the molecular formula C15H19Cl2NO2 and a molecular weight of 316.23 g/mol. Its IUPAC name is N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide
PubChem CID110015514
Molecular FormulaC15H19Cl2NO2
Molecular Weight316.23 g/mol
Exact Mass315.08
IUPAC NameN-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide
SMILESCC(C)(NC(=O)C1CCCC1O)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C15H19Cl2NO2/c1-15(2,9-6-7-11(16)12(17)8-9)18-14(20)10-4-3-5-13(10)19/h6-8,10,13,19H,3-5H2,1-2H3,(H,18,20)
InChIKeyPAURSWYTCRWAGS-UHFFFAOYSA-N
XLogP3.51
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.23
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119758543
2-cyclopentyl-2-(3,4-dichlorophenyl)propanoic acid
CID 67957962
N-(3-acetamido-4-chlorophenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110015470
cis-(1R,2S)-N-(3,4-dichlorophenyl)-2-hydroxy-N-methylcyclohexane-1-carboxamide
CID 69305559
2-(3,4-dichlorophenyl)-2-[[(1R,5S)-3-oxabicyclo[3.1.0]hexane-6-carbonyl]amino]propanoic acid
CID 136583482
2-[2-(3-chlorophenyl)propan-2-ylcarbamoyl]cyclopropane-1-carboxylic acid
CID 119185997
N-[2-(4-chlorophenyl)propan-2-yl]oxane-4-carboxamide
CID 113091859
methyl 5-[2-(3,4-dichlorophenyl)propan-2-ylcarbamoyl]thiophene-2-carboxylate
CID 47087127
N-[2-(3,4-dichlorophenyl)-2-methylpropyl]piperidine-3-carboxamide;hydrochloride
CID 119311595
N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-thiomorpholin-3-ylacetamide
CID 119938128
1-[(1S,2S)-2-hydroxycyclohexyl]-3-[2-[3-[2-[[(1R,2S)-2-hydroxycyclohexyl]carbamoylamino]propan-2-yl]phenyl]propan-2-yl]urea
CID 26791318
N-[2-(3,4-dichlorophenyl)propan-2-yl]-4-[(2,5-dioxopyrrolidin-1-yl)methyl]benzamide
CID 49149193

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide (CID 110015514) is N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide is CC(C)(NC(=O)C1CCCC1O)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide?
The InChIKey is PAURSWYTCRWAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19Cl2NO2/c1-15(2,9-6-7-11(16)12(17)8-9)18-14(20)10-4-3-5-13(10)19/h6-8,10,13,19H,3-5H2,1-2H3,(H,18,20).
What are the key properties of N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide?
N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide has a molecular weight of 316.23 g/mol, XLogP of 3.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110015514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).