N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide

C12H23N3O3S — CID 128935956

IUPACN-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide
SMILESCC1CCN(C(=O)NCCS(=O)(=O)NC2CC2)CC1
InChIInChI=1S/C12H23N3O3S/c1-10-4-7-15(8-5-10)12(16)13-6-9-19(17,18)14-11-2-3-11/h10-11,14H,2-9H2,1H3,(H,13,16)
InChIKeyLRVWRCNBDQESAF-UHFFFAOYSA-N
MW289.40 g/mol
LogP0.51
Rot. Bonds5

About N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide

N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide (PubChem CID 128935956) has the molecular formula C12H23N3O3S and a molecular weight of 289.40 g/mol. Its IUPAC name is N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide
PubChem CID128935956
Molecular FormulaC12H23N3O3S
Molecular Weight289.40 g/mol
Exact Mass289.15
IUPAC NameN-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide
SMILESCC1CCN(C(=O)NCCS(=O)(=O)NC2CC2)CC1
InChIInChI=1S/C12H23N3O3S/c1-10-4-7-15(8-5-10)12(16)13-6-9-19(17,18)14-11-2-3-11/h10-11,14H,2-9H2,1H3,(H,13,16)
InChIKeyLRVWRCNBDQESAF-UHFFFAOYSA-N
XLogP0.51
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclobutyl-3-sulfamoylpiperidine-1-carboxamide
CID 116658849
1-((1-(Cyclopropylsulfonyl)piperidin-4-yl)methyl)-3-ethylurea
CID 49692353
4-(Cyclopropylmethyl)-4-methanesulfonamido-N-(2-methylpropyl)piperidine-1-carboxamide
CID 124076885
N-(2-tert-butylsulfonylethyl)-3,5-dimethylpiperidine-1-carboxamide
CID 71867717
1-[(1S)-1-cyclopropylethyl]-3-[3-(ethylsulfonylamino)propyl]-1-methylurea
CID 95635035
3-[(1,1-dioxothian-4-yl)methyl]-1-methyl-1-[(1S)-1-(1-methylcyclopropyl)ethyl]urea
CID 97327646
2,2-diethyl-N-(3-methylbutyl)-1,1-dioxo-1,4-thiazinane-4-carboxamide
CID 100704369
N-[(1R,2R)-2-ethylcyclopropyl]-4-(sulfamoylmethyl)piperidine-1-carboxamide
CID 119051544
N-cyclobutyl-4-(methylsulfamoyl)piperidine-1-carboxamide
CID 127307374
1-Ethyl-3-((1-(methylsulfonyl)piperidin-4-yl)methyl)urea
CID 49688371
1-Isopropyl-3-((1-(methylsulfonyl)piperidin-4-yl)methyl)urea
CID 49688374
N,N-dimethyl-4-[(3,3,3-trifluoropropanesulfonamido)methyl]piperidine-1-carboxamide
CID 121020495

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide (CID 128935956) is N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide is CC1CCN(C(=O)NCCS(=O)(=O)NC2CC2)CC1.
What is the InChIKey of N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide?
The InChIKey is LRVWRCNBDQESAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3S/c1-10-4-7-15(8-5-10)12(16)13-6-9-19(17,18)14-11-2-3-11/h10-11,14H,2-9H2,1H3,(H,13,16).
What are the key properties of N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide?
N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide has a molecular weight of 289.40 g/mol, XLogP of 0.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylsulfamoyl)ethyl]-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 128935956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).