N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide

C11H23N3O3S — CID 106339565

IUPACN-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(=O)NCCCNS(C)(=O)=O)CN1
InChIInChI=1S/C11H23N3O3S/c1-9-4-5-10(8-13-9)11(15)12-6-3-7-14-18(2,16)17/h9-10,13-14H,3-8H2,1-2H3,(H,12,15)
InChIKeyAIEXISDMQPHVNF-UHFFFAOYSA-N
MW277.39 g/mol
LogP-0.57
Rot. Bonds6

About N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide

N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide (PubChem CID 106339565) has the molecular formula C11H23N3O3S and a molecular weight of 277.39 g/mol. Its IUPAC name is N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide
PubChem CID106339565
Molecular FormulaC11H23N3O3S
Molecular Weight277.39 g/mol
Exact Mass277.15
IUPAC NameN-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(=O)NCCCNS(C)(=O)=O)CN1
InChIInChI=1S/C11H23N3O3S/c1-9-4-5-10(8-13-9)11(15)12-6-3-7-14-18(2,16)17/h9-10,13-14H,3-8H2,1-2H3,(H,12,15)
InChIKeyAIEXISDMQPHVNF-UHFFFAOYSA-N
XLogP-0.57
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(methanesulfonamido)propyl]-6-oxopiperidine-3-carboxamide
CID 103617435
N-[3-(methanesulfonamido)propyl]-2-methylpiperidine-3-carboxamide
CID 114175575
6-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidine-3-carboxamide
CID 63829009
N-[2-(methanesulfonamido)ethyl]cyclopentanecarboxamide
CID 36904039
N-[3-(methanesulfonamido)propyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 103872583
N-carbamoyl-6-methylpiperidine-3-carboxamide
CID 131001630
3-amino-N-[3-(methanesulfonamido)propyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 103809087
N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide
CID 114942625
6-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide
CID 106026312
2-[2-(methanesulfonamido)ethylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120976004
(3S)-N-(3-methylsulfonylpropyl)piperidine-3-carboxamide
CID 81128243
N-[3-(methanesulfonamido)propyl]-1,2,3,4-tetrahydroquinoline-2-carboxamide
CID 106339564

Frequently Asked Questions

What is the IUPAC name of N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide?
The IUPAC name of N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide (CID 106339565) is N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide?
The canonical SMILES for N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide is CC1CCC(C(=O)NCCCNS(C)(=O)=O)CN1.
What is the InChIKey of N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide?
The InChIKey is AIEXISDMQPHVNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3S/c1-9-4-5-10(8-13-9)11(15)12-6-3-7-14-18(2,16)17/h9-10,13-14H,3-8H2,1-2H3,(H,12,15).
What are the key properties of N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide?
N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide has a molecular weight of 277.39 g/mol, XLogP of -0.57, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methanesulfonamido)propyl]-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 106339565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).