2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide

C15H25N3O — CID 95149850

IUPAC2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN1CCN([C@H]2C=CCCC2)CC1
InChIInChI=1S/C15H25N3O/c1-2-8-16-15(19)13-17-9-11-18(12-10-17)14-6-4-3-5-7-14/h2,4,6,14H,1,3,5,7-13H2,(H,16,19)/t14-/m0/s1
InChIKeyLQZQWKNEIVQBEG-AWEZNQCLSA-N
MW263.38 g/mol
LogP1.01
Rot. Bonds5

About 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide

2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide (PubChem CID 95149850) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide
PubChem CID95149850
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN1CCN([C@H]2C=CCCC2)CC1
InChIInChI=1S/C15H25N3O/c1-2-8-16-15(19)13-17-9-11-18(12-10-17)14-6-4-3-5-7-14/h2,4,6,14H,1,3,5,7-13H2,(H,16,19)/t14-/m0/s1
InChIKeyLQZQWKNEIVQBEG-AWEZNQCLSA-N
XLogP1.01
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide 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 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide?
The IUPAC name of 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide (CID 95149850) is 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide.
What is the SMILES notation for 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide?
The canonical SMILES for 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide is C=CCNC(=O)CN1CCN([C@H]2C=CCCC2)CC1.
What is the InChIKey of 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide?
The InChIKey is LQZQWKNEIVQBEG-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H25N3O/c1-2-8-16-15(19)13-17-9-11-18(12-10-17)14-6-4-3-5-7-14/h2,4,6,14H,1,3,5,7-13H2,(H,16,19)/t14-/m0/s1.
What are the key properties of 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide?
2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide has a molecular weight of 263.38 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(1R)-cyclohex-2-en-1-yl]piperazin-1-yl]-N-prop-2-enylacetamide is sourced from PubChem (CID 95149850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).