N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride

C15H24ClN3O4S — CID 119298110

IUPACN-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride
SMILESCCS(=O)(=O)Nc1ccc(NC(=O)C2CCNCC2)cc1OC.Cl
InChIInChI=1S/C15H23N3O4S.ClH/c1-3-23(20,21)18-13-5-4-12(10-14(13)22-2)17-15(19)11-6-8-16-9-7-11;/h4-5,10-11,16,18H,3,6-9H2,1-2H3,(H,17,19);1H
InChIKeyOOVQYDBTXVKPSY-UHFFFAOYSA-N
MW377.89 g/mol
LogP1.82
Rot. Bonds6

About N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride

N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride (PubChem CID 119298110) has the molecular formula C15H24ClN3O4S and a molecular weight of 377.89 g/mol. Its IUPAC name is N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride
PubChem CID119298110
Molecular FormulaC15H24ClN3O4S
Molecular Weight377.89 g/mol
Exact Mass377.12
IUPAC NameN-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride
SMILESCCS(=O)(=O)Nc1ccc(NC(=O)C2CCNCC2)cc1OC.Cl
InChIInChI=1S/C15H23N3O4S.ClH/c1-3-23(20,21)18-13-5-4-12(10-14(13)22-2)17-15(19)11-6-8-16-9-7-11;/h4-5,10-11,16,18H,3,6-9H2,1-2H3,(H,17,19);1H
InChIKeyOOVQYDBTXVKPSY-UHFFFAOYSA-N
XLogP1.82
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.89
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-3-carboxamide;hydrochloride
CID 119298124
(2R,3S)-N-[4-(ethylsulfonylamino)-3-methoxyphenyl]-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120926431
N-(4-acetamido-3-methoxyphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119713245
N-[4-(ethylsulfonylamino)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119711147
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]piperidine-4-carboxamide;dihydrochloride
CID 119865014
2-(cyclopropylmethylamino)-N-[4-(ethylsulfonylamino)-3-methoxyphenyl]acetamide
CID 119739337
4-butyl-N-[4-(methanesulfonamido)-3-methoxyphenyl]cyclohexane-1-carboxamide
CID 37257828
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]piperidine-4-carboxamide
CID 119865015
N-(2-methoxy-4-methylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119298753
N-[4-methoxy-3-(2,2,2-trifluoroethoxy)phenyl]piperidine-4-carboxamide
CID 119286140
N-[4-(ethylsulfonylamino)-3-methoxyphenyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 55956907
3-N-[4-(ethylsulfonylamino)-3-methoxyphenyl]-1-N-(3-methylphenyl)piperidine-1,3-dicarboxamide
CID 55982410

Frequently Asked Questions

What is the IUPAC name of N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride (CID 119298110) is N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride is CCS(=O)(=O)Nc1ccc(NC(=O)C2CCNCC2)cc1OC.Cl.
What is the InChIKey of N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride?
The InChIKey is OOVQYDBTXVKPSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4S.ClH/c1-3-23(20,21)18-13-5-4-12(10-14(13)22-2)17-15(19)11-6-8-16-9-7-11;/h4-5,10-11,16,18H,3,6-9H2,1-2H3,(H,17,19);1H.
What are the key properties of N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride?
N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride has a molecular weight of 377.89 g/mol, XLogP of 1.82, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(ethylsulfonylamino)-3-methoxyphenyl]piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119298110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).