(6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one

C10H17NO — CID 155014496

IUPAC(6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one
SMILESC/C=C1\CCCC(=O)N1C(C)C
InChIInChI=1S/C10H17NO/c1-4-9-6-5-7-10(12)11(9)8(2)3/h4,8H,5-7H2,1-3H3/b9-4+
InChIKeyOHIAFOVYJWOBMJ-RUDMXATFSA-N
MW167.25 g/mol
LogP2.31
Rot. Bonds1

About (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one

(6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one (PubChem CID 155014496) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one.

Molecular Properties

Compound Name(6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one
PubChem CID155014496
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name(6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one
SMILESC/C=C1\CCCC(=O)N1C(C)C
InChIInChI=1S/C10H17NO/c1-4-9-6-5-7-10(12)11(9)8(2)3/h4,8H,5-7H2,1-3H3/b9-4+
InChIKeyOHIAFOVYJWOBMJ-RUDMXATFSA-N
XLogP2.31
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one?
The IUPAC name of (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one (CID 155014496) is (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one.
What is the SMILES notation for (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one?
The canonical SMILES for (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one is C/C=C1\CCCC(=O)N1C(C)C.
What is the InChIKey of (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one?
The InChIKey is OHIAFOVYJWOBMJ-RUDMXATFSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-9-6-5-7-10(12)11(9)8(2)3/h4,8H,5-7H2,1-3H3/b9-4+.
What are the key properties of (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one?
(6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one has a molecular weight of 167.25 g/mol, XLogP of 2.31, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-6-ethylidene-1-propan-2-ylpiperidin-2-one is sourced from PubChem (CID 155014496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).