N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide

C12H25N3O3S — CID 106740092

IUPACN-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide
SMILESCC1CC(C(=O)NCC(C)(C)NS(C)(=O)=O)CCN1
InChIInChI=1S/C12H25N3O3S/c1-9-7-10(5-6-13-9)11(16)14-8-12(2,3)15-19(4,17)18/h9-10,13,15H,5-8H2,1-4H3,(H,14,16)
InChIKeyYOGNHIRUMGMODF-UHFFFAOYSA-N
MW291.42 g/mol
LogP-0.18
Rot. Bonds5

About N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide

N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide (PubChem CID 106740092) has the molecular formula C12H25N3O3S and a molecular weight of 291.42 g/mol. Its IUPAC name is N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide
PubChem CID106740092
Molecular FormulaC12H25N3O3S
Molecular Weight291.42 g/mol
Exact Mass291.16
IUPAC NameN-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide
SMILESCC1CC(C(=O)NCC(C)(C)NS(C)(=O)=O)CCN1
InChIInChI=1S/C12H25N3O3S/c1-9-7-10(5-6-13-9)11(16)14-8-12(2,3)15-19(4,17)18/h9-10,13,15H,5-8H2,1-4H3,(H,14,16)
InChIKeyYOGNHIRUMGMODF-UHFFFAOYSA-N
XLogP-0.18
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 5-0.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-(methanesulfonamido)-2-methylpropyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 63858507
methyl 2,2-dimethyl-3-[[(2S,4S)-2-methylpiperidine-4-carbonyl]amino]propanoate
CID 120633673
2-methyl-N-(2-methyl-2-phenylpropyl)piperidine-4-carboxamide
CID 106739532
(2S,4S)-N-(2-cyclopropylethyl)-2-methylpiperidine-4-carboxamide
CID 120633867
N-(2-hydroxyethyl)-2-methylpiperidine-4-carboxamide
CID 106738732
2-methyl-N-prop-2-ynylpiperidine-4-carboxamide
CID 106738666
N-(cyanomethyl)-2-methylpiperidine-4-carboxamide
CID 106739785
ethyl 3-[(2-methylpiperidine-4-carbonyl)amino]propanoate
CID 106739889
(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide
CID 130877690
2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide
CID 106740120
(2S,4S)-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)piperidine-4-carboxamide
CID 120621777
2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)piperidine-4-carboxamide
CID 106740605

Frequently Asked Questions

What is the IUPAC name of N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide?
The IUPAC name of N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide (CID 106740092) is N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide?
The canonical SMILES for N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide is CC1CC(C(=O)NCC(C)(C)NS(C)(=O)=O)CCN1.
What is the InChIKey of N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide?
The InChIKey is YOGNHIRUMGMODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3S/c1-9-7-10(5-6-13-9)11(16)14-8-12(2,3)15-19(4,17)18/h9-10,13,15H,5-8H2,1-4H3,(H,14,16).
What are the key properties of N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide?
N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide has a molecular weight of 291.42 g/mol, XLogP of -0.18, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methanesulfonamido)-2-methylpropyl]-2-methylpiperidine-4-carboxamide is sourced from PubChem (CID 106740092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).