2-methyl-N-(2-oxopiperidin-4-yl)propanamide

C9H16N2O2 — CID 112534578

IUPAC2-methyl-N-(2-oxopiperidin-4-yl)propanamide
SMILESCC(C)C(=O)NC1CCNC(=O)C1
InChIInChI=1S/C9H16N2O2/c1-6(2)9(13)11-7-3-4-10-8(12)5-7/h6-7H,3-5H2,1-2H3,(H,10,12)(H,11,13)
InChIKeyQOXPPSOSRJSARD-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.04
Rot. Bonds2

About 2-methyl-N-(2-oxopiperidin-4-yl)propanamide

2-methyl-N-(2-oxopiperidin-4-yl)propanamide (PubChem CID 112534578) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 2-methyl-N-(2-oxopiperidin-4-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(2-oxopiperidin-4-yl)propanamide
PubChem CID112534578
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name2-methyl-N-(2-oxopiperidin-4-yl)propanamide
SMILESCC(C)C(=O)NC1CCNC(=O)C1
InChIInChI=1S/C9H16N2O2/c1-6(2)9(13)11-7-3-4-10-8(12)5-7/h6-7H,3-5H2,1-2H3,(H,10,12)(H,11,13)
InChIKeyQOXPPSOSRJSARD-UHFFFAOYSA-N
XLogP0.04
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-2-[(2-oxoazepan-4-yl)amino]propanamide
CID 113406853
2-methyl-N-(3-oxocyclohexyl)propanamide
CID 164677071
2-methyl-N-[4-(2-methylpropanoylamino)cyclohexyl]propanamide
CID 5083762
3-methyl-N-(2-oxopiperidin-4-yl)benzamide
CID 112534523
N-(2-oxopiperidin-4-yl)-3-pyrrolidin-1-ylpropanamide
CID 112534506
2-oxo-N-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide
CID 139302184
methyl 2-amino-2-(2-oxopiperidin-4-yl)acetate
CID 169193401
N-(7-oxoazepan-4-yl)propanamide
CID 131010978
N-cyclohexyl-2-methylpropanamide;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-4-propan-2-yloxypiperidine;N-propan-2-ylcyclohexanamine;propan-2-yloxycyclohexane;4-propan-2-yloxypiperidin-2-one
CID 159563350
3-fluoro-N-(2-oxopiperidin-4-yl)benzamide
CID 112534527
3,5,7-trimethyl-N-[(4S)-2-oxoazepan-4-yl]adamantane-1-carboxamide
CID 68593909
2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide
CID 167069682

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-oxopiperidin-4-yl)propanamide?
The IUPAC name of 2-methyl-N-(2-oxopiperidin-4-yl)propanamide (CID 112534578) is 2-methyl-N-(2-oxopiperidin-4-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(2-oxopiperidin-4-yl)propanamide?
The canonical SMILES for 2-methyl-N-(2-oxopiperidin-4-yl)propanamide is CC(C)C(=O)NC1CCNC(=O)C1.
What is the InChIKey of 2-methyl-N-(2-oxopiperidin-4-yl)propanamide?
The InChIKey is QOXPPSOSRJSARD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-6(2)9(13)11-7-3-4-10-8(12)5-7/h6-7H,3-5H2,1-2H3,(H,10,12)(H,11,13).
What are the key properties of 2-methyl-N-(2-oxopiperidin-4-yl)propanamide?
2-methyl-N-(2-oxopiperidin-4-yl)propanamide has a molecular weight of 184.24 g/mol, XLogP of 0.04, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-oxopiperidin-4-yl)propanamide is sourced from PubChem (CID 112534578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).