N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride

C15H23ClN2O — CID 169452615

IUPACN,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1cc(C2CCNCC2)ccc1C(=O)N(C)C.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11-10-13(12-6-8-16-9-7-12)4-5-14(11)15(18)17(2)3;/h4-5,10,12,16H,6-9H2,1-3H3;1H
InChIKeyRRPFONBRNQRIDK-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.59
Rot. Bonds2

About N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride

N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride (PubChem CID 169452615) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride.

Molecular Properties

Compound NameN,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride
PubChem CID169452615
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1cc(C2CCNCC2)ccc1C(=O)N(C)C.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11-10-13(12-6-8-16-9-7-12)4-5-14(11)15(18)17(2)3;/h4-5,10,12,16H,6-9H2,1-3H3;1H
InChIKeyRRPFONBRNQRIDK-UHFFFAOYSA-N
XLogP2.59
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 ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-2-methyl-4-piperidin-4-ylbenzamide
CID 169452618
2-fluoro-N,N,6-trimethyl-4-piperidin-4-ylbenzamide
CID 171365240
N,N,3-trimethyl-4-piperidin-4-ylbenzamide
CID 70330604
2-methyl-5-piperidin-4-ylbenzamide
CID 175991950
N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride
CID 171362069
N,2-dimethyl-5-piperidin-4-ylbenzamide
CID 171361874
N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 171361893
2-methyl-4-piperidin-4-ylbenzonitrile
CID 68519777
2-methyl-5-piperidin-4-ylaniline
CID 105444511
4-piperidin-4-ylbenzamide;hydrochloride
CID 68719929
(2S,4S)-N-[4-(dimethylcarbamoyl)-3-methylphenyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120635307
N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
CID 60807085

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride?
The IUPAC name of N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride (CID 169452615) is N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride.
What is the SMILES notation for N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride?
The canonical SMILES for N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride is Cc1cc(C2CCNCC2)ccc1C(=O)N(C)C.Cl.
What is the InChIKey of N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride?
The InChIKey is RRPFONBRNQRIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-11-10-13(12-6-8-16-9-7-12)4-5-14(11)15(18)17(2)3;/h4-5,10,12,16H,6-9H2,1-3H3;1H.
What are the key properties of N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride?
N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride is sourced from PubChem (CID 169452615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).