cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone

C11H18N2O — CID 6467866

IUPACcyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone
SMILESC=CCN1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C11H18N2O/c1-2-5-12-6-8-13(9-7-12)11(14)10-3-4-10/h2,10H,1,3-9H2
InChIKeyWPXSKDCEKBLBPN-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.73
Rot. Bonds3

About cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone

cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone (PubChem CID 6467866) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone.

Molecular Properties

Compound Namecyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone
PubChem CID6467866
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Namecyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone
SMILESC=CCN1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C11H18N2O/c1-2-5-12-6-8-13(9-7-12)11(14)10-3-4-10/h2,10H,1,3-9H2
InChIKeyWPXSKDCEKBLBPN-UHFFFAOYSA-N
XLogP0.73
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone with MolForge

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

Launch Full Analysis

Related Compounds

2-oxo-2-(4-prop-2-enylpiperazin-1-yl)acetic acid
CID 2050807
1-[4-(cyclopropanecarbonyl)piperazin-1-yl]propan-2-one
CID 82126762
[4-(methylamino)oxolan-3-yl]-(4-prop-2-enylpiperazin-1-yl)methanone
CID 66266429
cyclopropyl-[4-(2-hydroxypropyl)piperazin-1-yl]methanone
CID 82113410
1-(1-prop-2-enylpiperidin-4-yl)ethanone;hydrochloride
CID 159798252
4-(4-acetylpiperazine-1-carbonyl)-N-prop-2-enylcyclohexane-1-carboxamide
CID 109144861
prop-2-enyl 1-(cyclopropanecarbonyl)piperidine-4-carboxylate
CID 78832432
[4-(4-aminobutyl)piperazin-1-yl]-cyclopropylmethanone
CID 43251850
1-[4-[4-(4-acetylpiperazine-1-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 2375184
(1R,2R,9R)-11-[4-(4-prop-2-enylpiperazine-1-carbonyl)piperidine-1-carbonyl]-7,11-diazatricyclo[7.3.1.02,7]tridecan-6-one
CID 110195491
cyclopropyl-(8-prop-2-enyl-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl)methanone
CID 155876988
1-prop-2-enylpiperidine;urea
CID 66978518

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone?
The IUPAC name of cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone (CID 6467866) is cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone.
What is the SMILES notation for cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone?
The canonical SMILES for cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone is C=CCN1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone?
The InChIKey is WPXSKDCEKBLBPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-2-5-12-6-8-13(9-7-12)11(14)10-3-4-10/h2,10H,1,3-9H2.
What are the key properties of cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone?
cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone has a molecular weight of 194.28 g/mol, XLogP of 0.73, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(4-prop-2-enylpiperazin-1-yl)methanone is sourced from PubChem (CID 6467866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).