N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide

C10H15NO — CID 139030440

IUPACN,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide
SMILESCNC(=O)C1=CC2CCC1(C)C2
InChIInChI=1S/C10H15NO/c1-10-4-3-7(6-10)5-8(10)9(12)11-2/h5,7H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyWMRAJXLDQUCYLG-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.48
Rot. Bonds1

About N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide

N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide (PubChem CID 139030440) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide.

Molecular Properties

Compound NameN,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide
PubChem CID139030440
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC NameN,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide
SMILESCNC(=O)C1=CC2CCC1(C)C2
InChIInChI=1S/C10H15NO/c1-10-4-3-7(6-10)5-8(10)9(12)11-2/h5,7H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyWMRAJXLDQUCYLG-UHFFFAOYSA-N
XLogP1.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide?
The IUPAC name of N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide (CID 139030440) is N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide.
What is the SMILES notation for N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide?
The canonical SMILES for N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide is CNC(=O)C1=CC2CCC1(C)C2.
What is the InChIKey of N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide?
The InChIKey is WMRAJXLDQUCYLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-10-4-3-7(6-10)5-8(10)9(12)11-2/h5,7H,3-4,6H2,1-2H3,(H,11,12).
What are the key properties of N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide?
N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide has a molecular weight of 165.24 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide is sourced from PubChem (CID 139030440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).