N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride

C12H21ClN2O — CID 53410651

IUPACN,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride
SMILESC=CCN(CC=C)C(=O)C1CCCCN1.Cl
InChIInChI=1S/C12H20N2O.ClH/c1-3-9-14(10-4-2)12(15)11-7-5-6-8-13-11;/h3-4,11,13H,1-2,5-10H2;1H
InChIKeyFAUAOMWGRFNQSG-UHFFFAOYSA-N
MW244.77 g/mol
LogP1.75
Rot. Bonds5

About N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride

N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 53410651) has the molecular formula C12H21ClN2O and a molecular weight of 244.77 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride
PubChem CID53410651
Molecular FormulaC12H21ClN2O
Molecular Weight244.77 g/mol
Exact Mass244.13
IUPAC NameN,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride
SMILESC=CCN(CC=C)C(=O)C1CCCCN1.Cl
InChIInChI=1S/C12H20N2O.ClH/c1-3-9-14(10-4-2)12(15)11-7-5-6-8-13-11;/h3-4,11,13H,1-2,5-10H2;1H
InChIKeyFAUAOMWGRFNQSG-UHFFFAOYSA-N
XLogP1.75
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.77
LogP ≤ 51.75
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-propan-2-yl-N-prop-2-enylazepane-2-carboxamide
CID 64562282
(2S)-N,N-bis(cyclopropylmethyl)piperidine-2-carboxamide
CID 103811837
(2R)-N,N-bis(2-amino-2-oxoethyl)piperidine-2-carboxamide
CID 104913884
(2R)-N-ethyl-N-propylpiperidine-2-carboxamide
CID 93272549
(2R)-N,N-diethylpyrrolidine-2-carboxamide
CID 952316
N-[(5-chlorothiophen-2-yl)methyl]-N-prop-2-enylpyrrolidine-2-carboxamide
CID 60717412
2-[ethyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
CID 104913780
(2R)-N,N-dipentylpiperidine-2-carboxamide
CID 93372342
(2R)-N-methyl-N-(2-methylprop-2-enyl)piperidine-2-carboxamide
CID 104914782
1-piperidin-2-ylprop-2-en-1-one
CID 116547790
N-(cyclopropylmethyl)-N-ethylazepane-2-carboxamide
CID 64570352
(2S)-N-ethyl-N-(2-methylpropyl)piperidine-2-carboxamide
CID 93273990

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride (CID 53410651) is N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride is C=CCN(CC=C)C(=O)C1CCCCN1.Cl.
What is the InChIKey of N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is FAUAOMWGRFNQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O.ClH/c1-3-9-14(10-4-2)12(15)11-7-5-6-8-13-11;/h3-4,11,13H,1-2,5-10H2;1H.
What are the key properties of N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride?
N,N-bis(prop-2-enyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 244.77 g/mol, XLogP of 1.75, 5 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)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 53410651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).