N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride

C14H22ClN3O4S — CID 119282638

IUPACN-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride
SMILESCOc1cc(NC(=O)C2CCCCN2)ccc1NS(C)(=O)=O.Cl
InChIInChI=1S/C14H21N3O4S.ClH/c1-21-13-9-10(6-7-11(13)17-22(2,19)20)16-14(18)12-5-3-4-8-15-12;/h6-7,9,12,15,17H,3-5,8H2,1-2H3,(H,16,18);1H
InChIKeyAPPBYFSPORQLKI-UHFFFAOYSA-N
MW363.87 g/mol
LogP1.57
Rot. Bonds5

About N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride

N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride (PubChem CID 119282638) has the molecular formula C14H22ClN3O4S and a molecular weight of 363.87 g/mol. Its IUPAC name is N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride
PubChem CID119282638
Molecular FormulaC14H22ClN3O4S
Molecular Weight363.87 g/mol
Exact Mass363.10
IUPAC NameN-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride
SMILESCOc1cc(NC(=O)C2CCCCN2)ccc1NS(C)(=O)=O.Cl
InChIInChI=1S/C14H21N3O4S.ClH/c1-21-13-9-10(6-7-11(13)17-22(2,19)20)16-14(18)12-5-3-4-8-15-12;/h6-7,9,12,15,17H,3-5,8H2,1-2H3,(H,16,18);1H
InChIKeyAPPBYFSPORQLKI-UHFFFAOYSA-N
XLogP1.57
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.87
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-(4-acetamido-3-methoxyphenyl)piperidine-2-carboxamide
CID 103808843
(2S)-N-(3,4-dimethoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 119673647
N-[3-chloro-4-(methanesulfonamido)phenyl]piperidine-2-carboxamide
CID 43711061
N-(3,4-dimethoxyphenyl)azepane-2-carboxamide
CID 64562794
(2R)-N-[4-fluoro-3-(methanesulfonamido)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119702945
(2R)-N-[3-chloro-4-(methanesulfonamido)phenyl]pyrrolidine-2-carboxamide
CID 104900746
N-[4-(methanesulfonamido)phenyl]piperidine-2-carboxamide
CID 43709925
N-(4-chloro-3-methoxyphenyl)azepane-2-carboxamide
CID 107621689
(2R)-N-(4-methoxy-3-methylphenyl)piperidine-2-carboxamide
CID 94222952
(2S)-N-(3-ethoxy-4-methoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 119717666
(2S)-N-(3,4,5-trimethoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 119671461
(2S)-N-(3-ethoxy-4-methoxyphenyl)piperidine-2-carboxamide
CID 103808938

Frequently Asked Questions

What is the IUPAC name of N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride (CID 119282638) is N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride is COc1cc(NC(=O)C2CCCCN2)ccc1NS(C)(=O)=O.Cl.
What is the InChIKey of N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride?
The InChIKey is APPBYFSPORQLKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O4S.ClH/c1-21-13-9-10(6-7-11(13)17-22(2,19)20)16-14(18)12-5-3-4-8-15-12;/h6-7,9,12,15,17H,3-5,8H2,1-2H3,(H,16,18);1H.
What are the key properties of N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride?
N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride has a molecular weight of 363.87 g/mol, XLogP of 1.57, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119282638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).