N-prop-2-enyl-N-propylpiperidine-1-carboxamide

C12H22N2O — CID 116657075

IUPACN-prop-2-enyl-N-propylpiperidine-1-carboxamide
SMILESC=CCN(CCC)C(=O)N1CCCCC1
InChIInChI=1S/C12H22N2O/c1-3-8-13(9-4-2)12(15)14-10-6-5-7-11-14/h3H,1,4-11H2,2H3
InChIKeyAUMRKTDREQSJPY-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.49
Rot. Bonds4

About N-prop-2-enyl-N-propylpiperidine-1-carboxamide

N-prop-2-enyl-N-propylpiperidine-1-carboxamide (PubChem CID 116657075) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-prop-2-enyl-N-propylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-prop-2-enyl-N-propylpiperidine-1-carboxamide
PubChem CID116657075
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-prop-2-enyl-N-propylpiperidine-1-carboxamide
SMILESC=CCN(CCC)C(=O)N1CCCCC1
InChIInChI=1S/C12H22N2O/c1-3-8-13(9-4-2)12(15)14-10-6-5-7-11-14/h3H,1,4-11H2,2H3
InChIKeyAUMRKTDREQSJPY-UHFFFAOYSA-N
XLogP2.49
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-propyl-N-prop-2-ynylpyrrolidine-1-carboxamide
CID 78969952
N-(cyclopropylmethyl)-N-propylpyrrolidine-1-carboxamide
CID 115578768
N,N-bis(prop-2-enyl)piperazine-1-carboxamide
CID 70546144
2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide
CID 108516735
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-N-prop-2-enylacetamide
CID 113115517
(3R)-1-(dipropylcarbamoyl)piperidine-3-carboxylic acid
CID 28512445
ethane;N-prop-2-enyl-N-propylprop-2-enamide
CID 143794226
4-ethyl-N,N-dipropylpiperazine-1-carboxamide
CID 108988508
N-piperidin-4-yl-N-propylazepane-1-carboxamide
CID 79152738
N,N-bis(2-methylpropyl)piperidine-1-carboxamide
CID 115589131
2-[prop-2-enyl(propyl)carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxylic acid
CID 102890618
2,2-dichloro-N-prop-2-enyl-N-propylacetamide
CID 21403948

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-N-propylpiperidine-1-carboxamide?
The IUPAC name of N-prop-2-enyl-N-propylpiperidine-1-carboxamide (CID 116657075) is N-prop-2-enyl-N-propylpiperidine-1-carboxamide.
What is the SMILES notation for N-prop-2-enyl-N-propylpiperidine-1-carboxamide?
The canonical SMILES for N-prop-2-enyl-N-propylpiperidine-1-carboxamide is C=CCN(CCC)C(=O)N1CCCCC1.
What is the InChIKey of N-prop-2-enyl-N-propylpiperidine-1-carboxamide?
The InChIKey is AUMRKTDREQSJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-3-8-13(9-4-2)12(15)14-10-6-5-7-11-14/h3H,1,4-11H2,2H3.
What are the key properties of N-prop-2-enyl-N-propylpiperidine-1-carboxamide?
N-prop-2-enyl-N-propylpiperidine-1-carboxamide has a molecular weight of 210.32 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-N-propylpiperidine-1-carboxamide is sourced from PubChem (CID 116657075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).