N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide

C10H15NO — CID 70134680

IUPACN,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide
SMILESCN(C)C(=O)C1CC2=CCC1C2
InChIInChI=1S/C10H15NO/c1-11(2)10(12)9-6-7-3-4-8(9)5-7/h3,8-9H,4-6H2,1-2H3
InChIKeyMKAQQFTYOSGOQI-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.43
Rot. Bonds1

About N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide

N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide (PubChem CID 70134680) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide
PubChem CID70134680
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC NameN,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide
SMILESCN(C)C(=O)C1CC2=CCC1C2
InChIInChI=1S/C10H15NO/c1-11(2)10(12)9-6-7-3-4-8(9)5-7/h3,8-9H,4-6H2,1-2H3
InChIKeyMKAQQFTYOSGOQI-UHFFFAOYSA-N
XLogP1.43
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.43
H-Bond Donors ≤ 50
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,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide?
The IUPAC name of N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide (CID 70134680) is N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide.
What is the SMILES notation for N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide?
The canonical SMILES for N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide is CN(C)C(=O)C1CC2=CCC1C2.
What is the InChIKey of N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide?
The InChIKey is MKAQQFTYOSGOQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-11(2)10(12)9-6-7-3-4-8(9)5-7/h3,8-9H,4-6H2,1-2H3.
What are the key properties of N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide?
N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide has a molecular weight of 165.24 g/mol, XLogP of 1.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylbicyclo[2.2.1]hept-4-ene-2-carboxamide is sourced from PubChem (CID 70134680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).