N,N-bis(prop-2-enyl)piperazine-1-carboxamide

C11H19N3O — CID 70546144

IUPACN,N-bis(prop-2-enyl)piperazine-1-carboxamide
SMILESC=CCN(CC=C)C(=O)N1CCNCC1
InChIInChI=1S/C11H19N3O/c1-3-7-13(8-4-2)11(15)14-9-5-12-6-10-14/h3-4,12H,1-2,5-10H2
InChIKeyGRIBCIGWMQBCPP-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.69
Rot. Bonds4

About N,N-bis(prop-2-enyl)piperazine-1-carboxamide

N,N-bis(prop-2-enyl)piperazine-1-carboxamide (PubChem CID 70546144) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)piperazine-1-carboxamide
PubChem CID70546144
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN,N-bis(prop-2-enyl)piperazine-1-carboxamide
SMILESC=CCN(CC=C)C(=O)N1CCNCC1
InChIInChI=1S/C11H19N3O/c1-3-7-13(8-4-2)11(15)14-9-5-12-6-10-14/h3-4,12H,1-2,5-10H2
InChIKeyGRIBCIGWMQBCPP-UHFFFAOYSA-N
XLogP0.69
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N,N-bis(prop-2-enyl)piperazine-1-carboxamide 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

N,N-diethylpiperazine-1-carboxamide;molecular hydrogen;hydrochloride
CID 43842039
N-prop-2-enyl-N-propylpiperidine-1-carboxamide
CID 116657075
2-[(5-oxo-1,4-diazepane-1-carbonyl)-prop-2-enylamino]acetic acid
CID 79286262
2-[morpholine-4-carbonyl(prop-2-enyl)amino]acetic acid
CID 79262594
N-[2-(dimethylamino)-2-oxoethyl]-N-ethylpiperazine-1-carboxamide
CID 54948205
5-[1-[bis(prop-2-enyl)carbamoyl]piperidin-4-yl]-1H-pyrazole-3-carboxylic acid
CID 166290612
2-[[4-(dimethylamino)piperidine-1-carbonyl]-prop-2-enylamino]acetic acid
CID 79275611
2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide
CID 108516735
bis(ethenyl) 1,4,7,10-tetrazacyclododecane-1,7-dicarboxylate
CID 14938690
2-(dimethylamino)-1-piperazin-1-ylethanone
CID 16770302
N-methyl-N-propan-2-ylpiperazine-1-carboxamide
CID 16791160
1-(1,4-diazepan-1-yl)-2-prop-2-enylpent-4-en-1-one
CID 119415239

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)piperazine-1-carboxamide?
The IUPAC name of N,N-bis(prop-2-enyl)piperazine-1-carboxamide (CID 70546144) is N,N-bis(prop-2-enyl)piperazine-1-carboxamide.
What is the SMILES notation for N,N-bis(prop-2-enyl)piperazine-1-carboxamide?
The canonical SMILES for N,N-bis(prop-2-enyl)piperazine-1-carboxamide is C=CCN(CC=C)C(=O)N1CCNCC1.
What is the InChIKey of N,N-bis(prop-2-enyl)piperazine-1-carboxamide?
The InChIKey is GRIBCIGWMQBCPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-7-13(8-4-2)11(15)14-9-5-12-6-10-14/h3-4,12H,1-2,5-10H2.
What are the key properties of N,N-bis(prop-2-enyl)piperazine-1-carboxamide?
N,N-bis(prop-2-enyl)piperazine-1-carboxamide has a molecular weight of 209.29 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)piperazine-1-carboxamide is sourced from PubChem (CID 70546144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).