3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide

C14H24N2O — CID 103824427

IUPAC3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNCC1CC2C=CC1C2
InChIInChI=1S/C14H24N2O/c1-14(2,13(17)15-3)9-16-8-12-7-10-4-5-11(12)6-10/h4-5,10-12,16H,6-9H2,1-3H3,(H,15,17)
InChIKeyMGFNQYDLFQSDMS-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.56
Rot. Bonds5

About 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide

3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide (PubChem CID 103824427) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide.

Molecular Properties

Compound Name3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide
PubChem CID103824427
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNCC1CC2C=CC1C2
InChIInChI=1S/C14H24N2O/c1-14(2,13(17)15-3)9-16-8-12-7-10-4-5-11(12)6-10/h4-5,10-12,16H,6-9H2,1-3H3,(H,15,17)
InChIKeyMGFNQYDLFQSDMS-UHFFFAOYSA-N
XLogP1.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-2-methylpropan-2-ol
CID 65102612
1-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-2,4-dimethylpentan-2-ol
CID 66178881
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-2,2-dimethyl-4-methylsulfonylbutan-1-amine
CID 75378004
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-3,3-dimethylbutan-1-amine
CID 115685496
N-[[(2R)-2-bicyclo[2.2.1]hept-5-enyl]methyl]acetamide
CID 130645148
3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)propanoic acid
CID 43774822
2-[[(1S,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]methylamino]ethanol
CID 98042869
2-[[(1R,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]methylamino]ethanol
CID 7236700
2-(2-bicyclo[2.2.1]hept-5-enylmethylamino)ethanol
CID 3154449
2-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-2-methylpropan-1-ol
CID 43771189
2-[2-[[(1R,2R,4S)-2-bicyclo[2.2.1]hept-5-enyl]methylamino]ethoxy]ethanol
CID 124526562
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)hydroxylamine
CID 13440364

Frequently Asked Questions

What is the IUPAC name of 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide?
The IUPAC name of 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide (CID 103824427) is 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide.
What is the SMILES notation for 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide?
The canonical SMILES for 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide is CNC(=O)C(C)(C)CNCC1CC2C=CC1C2.
What is the InChIKey of 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide?
The InChIKey is MGFNQYDLFQSDMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-14(2,13(17)15-3)9-16-8-12-7-10-4-5-11(12)6-10/h4-5,10-12,16H,6-9H2,1-3H3,(H,15,17).
What are the key properties of 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide?
3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide has a molecular weight of 236.36 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,2,2-trimethylpropanamide is sourced from PubChem (CID 103824427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).