N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride

C15H23ClN2O — CID 171362069

IUPACN,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1c(C(=O)N(C)C)cccc1C1CCNCC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11-13(12-7-9-16-10-8-12)5-4-6-14(11)15(18)17(2)3;/h4-6,12,16H,7-10H2,1-3H3;1H
InChIKeyRDBOUXZNTCTUQY-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.59
Rot. Bonds2

About N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride

N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride (PubChem CID 171362069) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride.

Molecular Properties

Compound NameN,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride
PubChem CID171362069
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1c(C(=O)N(C)C)cccc1C1CCNCC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11-13(12-7-9-16-10-8-12)5-4-6-14(11)15(18)17(2)3;/h4-6,12,16H,7-10H2,1-3H3;1H
InChIKeyRDBOUXZNTCTUQY-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-ethyl-2-methyl-3-piperidin-4-ylbenzamide;hydrochloride
CID 171362043
N-(cyclopropylmethyl)-2-methyl-3-piperidin-4-ylbenzamide
CID 171362054
2-cyclopropyl-N,N-dimethylbenzamide
CID 144712792
N,N,3-trimethyl-4-piperidin-4-ylbenzamide
CID 70330604
(2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone
CID 171362080
N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride
CID 169452615
(2-methylmorpholin-4-yl)-(2-methyl-3-piperidin-4-ylphenyl)methanone;hydrochloride
CID 171362081
1-(2-fluoro-3-piperidin-4-ylphenyl)ethanone
CID 57448055
2-methyl-6-piperidin-4-ylbenzamide
CID 174505124
3-(2-methyl-3-piperidin-4-ylphenyl)propanamide
CID 174472217
1-chloro-3-cyclohexyl-2-methylbenzene;4-(3-chloro-2-methylphenyl)piperidine;hydrochloride
CID 163597059
N,N-dimethyl-2-(2-piperidin-4-ylphenoxy)acetamide;hydrochloride
CID 22622337

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride?
The IUPAC name of N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride (CID 171362069) is N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride.
What is the SMILES notation for N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride?
The canonical SMILES for N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride is Cc1c(C(=O)N(C)C)cccc1C1CCNCC1.Cl.
What is the InChIKey of N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride?
The InChIKey is RDBOUXZNTCTUQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-11-13(12-7-9-16-10-8-12)5-4-6-14(11)15(18)17(2)3;/h4-6,12,16H,7-10H2,1-3H3;1H.
What are the key properties of N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride?
N,N,2-trimethyl-3-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-3-piperidin-4-ylbenzamide;hydrochloride is sourced from PubChem (CID 171362069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).