N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride

C12H15Cl3N2O — CID 42943662

IUPACN-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(Cl)c(Cl)c1)C1CCCCN1
InChIInChI=1S/C12H14Cl2N2O.ClH/c13-9-5-4-8(7-10(9)14)16-12(17)11-3-1-2-6-15-11;/h4-5,7,11,15H,1-3,6H2,(H,16,17);1H
InChIKeyZODWVZFOWXDIHS-UHFFFAOYSA-N
MW309.62 g/mol
LogP3.50
Rot. Bonds2

About N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride

N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 42943662) has the molecular formula C12H15Cl3N2O and a molecular weight of 309.62 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride
PubChem CID42943662
Molecular FormulaC12H15Cl3N2O
Molecular Weight309.62 g/mol
Exact Mass308.02
IUPAC NameN-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(Cl)c(Cl)c1)C1CCCCN1
InChIInChI=1S/C12H14Cl2N2O.ClH/c13-9-5-4-8(7-10(9)14)16-12(17)11-3-1-2-6-15-11;/h4-5,7,11,15H,1-3,6H2,(H,16,17);1H
InChIKeyZODWVZFOWXDIHS-UHFFFAOYSA-N
XLogP3.50
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.62
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119262099
(2R)-N-(4-bromo-3-chlorophenyl)piperidine-2-carboxamide
CID 107620300
N-(4-bromo-3-chlorophenyl)azepane-2-carboxamide
CID 107620238
(2S)-N-(4-carbamoyl-3-chlorophenyl)piperidine-2-carboxamide
CID 103808831
(2R)-N-[4-chloro-3-(dimethylcarbamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119718954
N-(4-chloro-3-fluorophenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119281092
N-[3-chloro-4-(methanesulfonamido)phenyl]piperidine-2-carboxamide
CID 43711061
N-(4-chloro-3-methoxyphenyl)azepane-2-carboxamide
CID 107621689
N-(3-chloro-4-nitrophenyl)piperidine-2-carboxamide
CID 82864265
(2R)-N-(3-chlorophenyl)piperidine-2-carboxamide;hydrochloride
CID 119671014
(2R)-N-pyridin-4-ylpiperidine-2-carboxamide;dihydrochloride
CID 119827101
(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide
CID 93359932

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride (CID 42943662) is N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(Cl)c(Cl)c1)C1CCCCN1.
What is the InChIKey of N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is ZODWVZFOWXDIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N2O.ClH/c13-9-5-4-8(7-10(9)14)16-12(17)11-3-1-2-6-15-11;/h4-5,7,11,15H,1-3,6H2,(H,16,17);1H.
What are the key properties of N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride?
N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 309.62 g/mol, XLogP of 3.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 42943662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).