N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride

C17H26ClN3O5S — CID 119264815

IUPACN-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride
SMILESCOc1ccc(NC(=O)C2CCCCN2)cc1S(=O)(=O)N1CCOCC1.Cl
InChIInChI=1S/C17H25N3O5S.ClH/c1-24-15-6-5-13(19-17(21)14-4-2-3-7-18-14)12-16(15)26(22,23)20-8-10-25-11-9-20;/h5-6,12,14,18H,2-4,7-11H2,1H3,(H,19,21);1H
InChIKeySHUMBMTWIISYOW-UHFFFAOYSA-N
MW419.93 g/mol
LogP1.22
Rot. Bonds5

About N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride

N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 119264815) has the molecular formula C17H26ClN3O5S and a molecular weight of 419.93 g/mol. Its IUPAC name is N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride
PubChem CID119264815
Molecular FormulaC17H26ClN3O5S
Molecular Weight419.93 g/mol
Exact Mass419.13
IUPAC NameN-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride
SMILESCOc1ccc(NC(=O)C2CCCCN2)cc1S(=O)(=O)N1CCOCC1.Cl
InChIInChI=1S/C17H25N3O5S.ClH/c1-24-15-6-5-13(19-17(21)14-4-2-3-7-18-14)12-16(15)26(22,23)20-8-10-25-11-9-20;/h5-6,12,14,18H,2-4,7-11H2,1H3,(H,19,21);1H
InChIKeySHUMBMTWIISYOW-UHFFFAOYSA-N
XLogP1.22
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.93
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119264823
(2R)-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
CID 8800265
(2S)-N-(3,4-dimethoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 119673647
N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)piperidine-2-carboxamide
CID 119263645
N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-2,2-dimethylpropanamide
CID 4578456
N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-1-propylsulfonylpiperidine-2-carboxamide
CID 55817715
3-cyclohexyl-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)propanamide
CID 43008044
N-(3,4-dimethoxyphenyl)azepane-2-carboxamide
CID 64562794
N-[4-(methanesulfonamido)-3-methoxyphenyl]piperidine-2-carboxamide;hydrochloride
CID 119282638
(3S)-1-(benzenesulfonyl)-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide
CID 100660568
(2R)-N-(4-methoxy-3-methylphenyl)piperidine-2-carboxamide
CID 94222952
1-amino-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119264839

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride (CID 119264815) is N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride is COc1ccc(NC(=O)C2CCCCN2)cc1S(=O)(=O)N1CCOCC1.Cl.
What is the InChIKey of N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is SHUMBMTWIISYOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O5S.ClH/c1-24-15-6-5-13(19-17(21)14-4-2-3-7-18-14)12-16(15)26(22,23)20-8-10-25-11-9-20;/h5-6,12,14,18H,2-4,7-11H2,1H3,(H,19,21);1H.
What are the key properties of N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride?
N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 419.93 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119264815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).