N-prop-2-enylpiperidine-1-carboxamide

C9H16N2O — CID 15981520

IUPACN-prop-2-enylpiperidine-1-carboxamide
SMILESC=CCNC(=O)N1CCCCC1
InChIInChI=1S/C9H16N2O/c1-2-6-10-9(12)11-7-4-3-5-8-11/h2H,1,3-8H2,(H,10,12)
InChIKeyPDVUOSBHSBCFPV-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.37
Rot. Bonds2

About N-prop-2-enylpiperidine-1-carboxamide

N-prop-2-enylpiperidine-1-carboxamide (PubChem CID 15981520) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is N-prop-2-enylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-prop-2-enylpiperidine-1-carboxamide
PubChem CID15981520
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC NameN-prop-2-enylpiperidine-1-carboxamide
SMILESC=CCNC(=O)N1CCCCC1
InChIInChI=1S/C9H16N2O/c1-2-6-10-9(12)11-7-4-3-5-8-11/h2H,1,3-8H2,(H,10,12)
InChIKeyPDVUOSBHSBCFPV-UHFFFAOYSA-N
XLogP1.37
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-prop-2-enylpiperidine-1-carboxamide?
The IUPAC name of N-prop-2-enylpiperidine-1-carboxamide (CID 15981520) is N-prop-2-enylpiperidine-1-carboxamide.
What is the SMILES notation for N-prop-2-enylpiperidine-1-carboxamide?
The canonical SMILES for N-prop-2-enylpiperidine-1-carboxamide is C=CCNC(=O)N1CCCCC1.
What is the InChIKey of N-prop-2-enylpiperidine-1-carboxamide?
The InChIKey is PDVUOSBHSBCFPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-2-6-10-9(12)11-7-4-3-5-8-11/h2H,1,3-8H2,(H,10,12).
What are the key properties of N-prop-2-enylpiperidine-1-carboxamide?
N-prop-2-enylpiperidine-1-carboxamide has a molecular weight of 168.24 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enylpiperidine-1-carboxamide is sourced from PubChem (CID 15981520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).