N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide

C16H23N3O3S — CID 119287765

IUPACN-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCC2CC2)cc1)C1CCCNC1
InChIInChI=1S/C16H23N3O3S/c20-16(13-2-1-9-17-11-13)19-14-5-7-15(8-6-14)23(21,22)18-10-12-3-4-12/h5-8,12-13,17-18H,1-4,9-11H2,(H,19,20)
InChIKeyCMQMRBZSJZYCOX-UHFFFAOYSA-N
MW337.44 g/mol
LogP1.31
Rot. Bonds6

About N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide

N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide (PubChem CID 119287765) has the molecular formula C16H23N3O3S and a molecular weight of 337.44 g/mol. Its IUPAC name is N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide
PubChem CID119287765
Molecular FormulaC16H23N3O3S
Molecular Weight337.44 g/mol
Exact Mass337.15
IUPAC NameN-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCC2CC2)cc1)C1CCCNC1
InChIInChI=1S/C16H23N3O3S/c20-16(13-2-1-9-17-11-13)19-14-5-7-15(8-6-14)23(21,22)18-10-12-3-4-12/h5-8,12-13,17-18H,1-4,9-11H2,(H,19,20)
InChIKeyCMQMRBZSJZYCOX-UHFFFAOYSA-N
XLogP1.31
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.44
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-4-carboxamide
CID 119287751
N-[4-(propylsulfonylamino)phenyl]piperidine-3-carboxamide
CID 119306484
4-(benzenesulfonamidomethyl)-N-(4-chlorophenyl)cyclohexane-1-carboxamide
CID 11327244
N-[4-[(carbamoylamino)methyl]phenyl]piperidine-3-carboxamide
CID 119308510
N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide
CID 2987452
(3R)-N-[4-(diethylamino)phenyl]piperidine-3-carboxamide
CID 28807399
(3S)-N-[4-(dimethylamino)phenyl]piperidine-3-carboxamide
CID 28807397
(2R,3S)-N-[4-(cyclopropylmethylsulfamoyl)phenyl]-2-methylmorpholine-3-carboxamide
CID 120923924
N-[4-(propan-2-ylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 60927369
(3S)-N-[4-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide
CID 81119070
(3R)-N-[4-(difluoromethoxy)phenyl]piperidine-3-carboxamide
CID 81123871
methyl 2-[4-[[(3S)-piperidine-3-carbonyl]amino]phenoxy]acetate
CID 81118246

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide?
The IUPAC name of N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide (CID 119287765) is N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide?
The canonical SMILES for N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide is O=C(Nc1ccc(S(=O)(=O)NCC2CC2)cc1)C1CCCNC1.
What is the InChIKey of N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide?
The InChIKey is CMQMRBZSJZYCOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3S/c20-16(13-2-1-9-17-11-13)19-14-5-7-15(8-6-14)23(21,22)18-10-12-3-4-12/h5-8,12-13,17-18H,1-4,9-11H2,(H,19,20).
What are the key properties of N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide?
N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide has a molecular weight of 337.44 g/mol, XLogP of 1.31, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 119287765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).