3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide

C13H22N2O — CID 63132229

IUPAC3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide
SMILESC=CCN(CC=C)C(=O)C1(C)CCCNC1
InChIInChI=1S/C13H22N2O/c1-4-9-15(10-5-2)12(16)13(3)7-6-8-14-11-13/h4-5,14H,1-2,6-11H2,3H3
InChIKeyFHEBLNXWNPISOB-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.58
Rot. Bonds5

About 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide

3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide (PubChem CID 63132229) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide
PubChem CID63132229
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide
SMILESC=CCN(CC=C)C(=O)C1(C)CCCNC1
InChIInChI=1S/C13H22N2O/c1-4-9-15(10-5-2)12(16)13(3)7-6-8-14-11-13/h4-5,14H,1-2,6-11H2,3H3
InChIKeyFHEBLNXWNPISOB-UHFFFAOYSA-N
XLogP1.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-3-methyl-N-prop-2-enylpyrrolidine-3-carboxamide
CID 81489802
N,N-bis(prop-2-enyl)-3-propylpiperidine-3-carboxamide
CID 63132269
N,N-bis(2-methoxyethyl)-3-methylpiperidine-3-carboxamide
CID 63130592
N-butyl-N-(2-hydroxyethyl)-3-methylpiperidine-3-carboxamide
CID 63131141
N-ethyl-N-(2-methoxyethyl)-3-methylpiperidine-3-carboxamide
CID 63135216
N,N-bis(prop-2-enyl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 63708749
N-cyclobutyl-N,3-dimethylpiperidine-3-carboxamide
CID 115747528
4-methyl-1-(3-methylpiperidin-3-yl)pent-4-en-1-one
CID 114477930
methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate
CID 63131941
N-(2-hydroxy-2-methylpropyl)-N,3-dimethylpiperidine-3-carboxamide
CID 79377525
N-benzyl-3-methyl-N-propylpiperidine-3-carboxamide
CID 63130370
N,3-dimethyl-N-[2-(methylamino)-2-oxoethyl]piperidine-3-carboxamide
CID 63130187

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide?
The IUPAC name of 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide (CID 63132229) is 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide.
What is the SMILES notation for 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide?
The canonical SMILES for 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide is C=CCN(CC=C)C(=O)C1(C)CCCNC1.
What is the InChIKey of 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide?
The InChIKey is FHEBLNXWNPISOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-4-9-15(10-5-2)12(16)13(3)7-6-8-14-11-13/h4-5,14H,1-2,6-11H2,3H3.
What are the key properties of 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide?
3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide has a molecular weight of 222.33 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide is sourced from PubChem (CID 63132229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).