N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride

C15H23ClN2O — CID 119300463

IUPACN-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride
SMILESCc1cc(C)cc(N(C)C(=O)C2CCCNC2)c1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11-7-12(2)9-14(8-11)17(3)15(18)13-5-4-6-16-10-13;/h7-9,13,16H,4-6,10H2,1-3H3;1H
InChIKeyGGKGQXKJOBHTRO-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.69
Rot. Bonds2

About N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride

N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride (PubChem CID 119300463) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride
PubChem CID119300463
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride
SMILESCc1cc(C)cc(N(C)C(=O)C2CCCNC2)c1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11-7-12(2)9-14(8-11)17(3)15(18)13-5-4-6-16-10-13;/h7-9,13,16H,4-6,10H2,1-3H3;1H
InChIKeyGGKGQXKJOBHTRO-UHFFFAOYSA-N
XLogP2.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119300459
N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide
CID 62002271
N-(3,4-difluorophenyl)-N-methylpiperidine-3-carboxamide
CID 115159889
N-methyl-N-(1H-pyrrol-3-yl)piperidine-3-carboxamide
CID 115159892
N-methyl-N-naphthalen-2-ylpiperidine-3-carboxamide
CID 115159907
N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride
CID 119893048
N-(4-ethylphenyl)-N-methylpiperidine-3-carboxamide
CID 62002081
(3R)-N-(3-methoxyphenyl)-N-methylpiperidine-3-carboxamide
CID 81140173
N-methyl-N-(4-propylphenyl)piperidine-3-carboxamide
CID 115159880
N-(3,5-dimethylphenyl)-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride
CID 119743630
N-[2-(3,5-dimethylphenoxy)ethyl]-N-methylpiperidine-3-carboxamide
CID 60938004
(3S)-N-[2-(3,5-dimethylphenoxy)ethyl]-N-methylpiperidine-3-carboxamide
CID 81126354

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride (CID 119300463) is N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride is Cc1cc(C)cc(N(C)C(=O)C2CCCNC2)c1.Cl.
What is the InChIKey of N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride?
The InChIKey is GGKGQXKJOBHTRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-11-7-12(2)9-14(8-11)17(3)15(18)13-5-4-6-16-10-13;/h7-9,13,16H,4-6,10H2,1-3H3;1H.
What are the key properties of N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride?
N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119300463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).