2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide

C10H16N2O2 — CID 158386766

IUPAC2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide
SMILESC=C1CCC(NC(=O)C(C)C)C(=O)N1
InChIInChI=1S/C10H16N2O2/c1-6(2)9(13)12-8-5-4-7(3)11-10(8)14/h6,8H,3-5H2,1-2H3,(H,11,14)(H,12,13)
InChIKeySYXCLNSGDSQVTQ-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.55
Rot. Bonds2

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

2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide (PubChem CID 158386766) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide
PubChem CID158386766
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide
SMILESC=C1CCC(NC(=O)C(C)C)C(=O)N1
InChIInChI=1S/C10H16N2O2/c1-6(2)9(13)12-8-5-4-7(3)11-10(8)14/h6,8H,3-5H2,1-2H3,(H,11,14)(H,12,13)
InChIKeySYXCLNSGDSQVTQ-UHFFFAOYSA-N
XLogP0.55
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide?
The IUPAC name of 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide (CID 158386766) is 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide?
The canonical SMILES for 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide is C=C1CCC(NC(=O)C(C)C)C(=O)N1.
What is the InChIKey of 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide?
The InChIKey is SYXCLNSGDSQVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-6(2)9(13)12-8-5-4-7(3)11-10(8)14/h6,8H,3-5H2,1-2H3,(H,11,14)(H,12,13).
What are the key properties of 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide?
2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide has a molecular weight of 196.25 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)propanamide is sourced from PubChem (CID 158386766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).