N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide

C10H18N2O — CID 91303402

IUPACN-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide
SMILESCCC1C/C(=C/NC(C)=O)CCN1
InChIInChI=1S/C10H18N2O/c1-3-10-6-9(4-5-11-10)7-12-8(2)13/h7,10-11H,3-6H2,1-2H3,(H,12,13)/b9-7+
InChIKeyRAODCRUOVWQNCB-VQHVLOKHSA-N
MW182.27 g/mol
LogP1.17
Rot. Bonds2

About N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide

N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide (PubChem CID 91303402) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide.

Molecular Properties

Compound NameN-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide
PubChem CID91303402
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide
SMILESCCC1C/C(=C/NC(C)=O)CCN1
InChIInChI=1S/C10H18N2O/c1-3-10-6-9(4-5-11-10)7-12-8(2)13/h7,10-11H,3-6H2,1-2H3,(H,12,13)/b9-7+
InChIKeyRAODCRUOVWQNCB-VQHVLOKHSA-N
XLogP1.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide 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 N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide?
The IUPAC name of N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide (CID 91303402) is N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide.
What is the SMILES notation for N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide?
The canonical SMILES for N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide is CCC1C/C(=C/NC(C)=O)CCN1.
What is the InChIKey of N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide?
The InChIKey is RAODCRUOVWQNCB-VQHVLOKHSA-N. The full InChI is InChI=1S/C10H18N2O/c1-3-10-6-9(4-5-11-10)7-12-8(2)13/h7,10-11H,3-6H2,1-2H3,(H,12,13)/b9-7+.
What are the key properties of N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide?
N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide has a molecular weight of 182.27 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-ethylpiperidin-4-ylidene)methyl]acetamide is sourced from PubChem (CID 91303402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).