2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide

C11H18N2O2 — CID 161408901

IUPAC2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide
SMILESC=C1CCC(NC(=O)C(C)(C)C)C(=O)N1
InChIInChI=1S/C11H18N2O2/c1-7-5-6-8(9(14)12-7)13-10(15)11(2,3)4/h8H,1,5-6H2,2-4H3,(H,12,14)(H,13,15)
InChIKeyQMGBQWYHVRBQDX-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.94
Rot. Bonds1

About 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide

2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide (PubChem CID 161408901) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide
PubChem CID161408901
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide
SMILESC=C1CCC(NC(=O)C(C)(C)C)C(=O)N1
InChIInChI=1S/C11H18N2O2/c1-7-5-6-8(9(14)12-7)13-10(15)11(2,3)4/h8H,1,5-6H2,2-4H3,(H,12,14)(H,13,15)
InChIKeyQMGBQWYHVRBQDX-UHFFFAOYSA-N
XLogP0.94
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 59033215
4-methyl-7-(methylamino)-10-methylidene-2,3,4,7,8,9-hexahydro-1H-pyridazino[1,2-a]diazepin-6-one
CID 59730870
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CID 60104946
3,6-Di(butan-2-yl)-5-methylidenepiperazin-2-one
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CID 70648297
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(2S)-2-[[(2S)-2,4-diaminobutanoyl]amino]-N-[(3S)-2,5-diaminopent-1-en-3-yl]pentanamide
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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide (CID 161408901) is 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide is C=C1CCC(NC(=O)C(C)(C)C)C(=O)N1.
What is the InChIKey of 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide?
The InChIKey is QMGBQWYHVRBQDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-7-5-6-8(9(14)12-7)13-10(15)11(2,3)4/h8H,1,5-6H2,2-4H3,(H,12,14)(H,13,15).
What are the key properties of 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide?
2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide has a molecular weight of 210.28 g/mol, XLogP of 0.94, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide is sourced from PubChem (CID 161408901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).