N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide

C13H16Cl2N2O — CID 54856064

IUPACN-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide
SMILESCC1CCCC(C(=O)Nc2cc(Cl)cc(Cl)c2)N1
InChIInChI=1S/C13H16Cl2N2O/c1-8-3-2-4-12(16-8)13(18)17-11-6-9(14)5-10(15)7-11/h5-8,12,16H,2-4H2,1H3,(H,17,18)
InChIKeyMAXUYTPJEWTXOV-UHFFFAOYSA-N
MW287.19 g/mol
LogP3.46
Rot. Bonds2

About N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide

N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide (PubChem CID 54856064) has the molecular formula C13H16Cl2N2O and a molecular weight of 287.19 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide
PubChem CID54856064
Molecular FormulaC13H16Cl2N2O
Molecular Weight287.19 g/mol
Exact Mass286.06
IUPAC NameN-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide
SMILESCC1CCCC(C(=O)Nc2cc(Cl)cc(Cl)c2)N1
InChIInChI=1S/C13H16Cl2N2O/c1-8-3-2-4-12(16-8)13(18)17-11-6-9(14)5-10(15)7-11/h5-8,12,16H,2-4H2,1H3,(H,17,18)
InChIKeyMAXUYTPJEWTXOV-UHFFFAOYSA-N
XLogP3.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.19
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3,5-dichlorophenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 75115965
(2S)-N-(3,5-dichlorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 26469933
trans-(1S,2S)-2-[(3,5-dichlorophenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 888025
(2R)-N-(3-chloro-5-fluorophenyl)pyrrolidine-2-carboxamide
CID 107365936
3-chloro-5-[[(2S)-piperidine-2-carbonyl]amino]benzoic acid
CID 104914413
(1R,6S)-6-[(3,5-dichlorophenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
CID 896988
N-(3,5-dichlorophenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 46216647
2-[(3,5-dichlorophenyl)carbamoylamino]cyclopentane-1-carboxylic acid
CID 64818045
sodium cis-(1R,2S)-2-[(3,5-dichlorophenyl)carbamoyl]cyclohexane-1-carboxylate
CID 56972207
6-methyl-N-[1-(methylamino)-1-oxopropan-2-yl]piperidine-2-carboxamide
CID 61467409
N-(3,5-dichlorophenyl)-1-[(2S,4S)-2-methylpiperidine-4-carbonyl]pyrrolidine-2-carboxamide;hydrochloride
CID 120623358
1-(2-aminocyclopentyl)-3-(3,5-dichlorophenyl)urea
CID 107654072

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide?
The IUPAC name of N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide (CID 54856064) is N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide is CC1CCCC(C(=O)Nc2cc(Cl)cc(Cl)c2)N1.
What is the InChIKey of N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide?
The InChIKey is MAXUYTPJEWTXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16Cl2N2O/c1-8-3-2-4-12(16-8)13(18)17-11-6-9(14)5-10(15)7-11/h5-8,12,16H,2-4H2,1H3,(H,17,18).
What are the key properties of N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide?
N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide has a molecular weight of 287.19 g/mol, XLogP of 3.46, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-6-methylpiperidine-2-carboxamide is sourced from PubChem (CID 54856064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).