N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine

C15H26N2 — CID 113253498

IUPACN-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine
SMILESCC1CN(C)CCC1NCC1CC2C=CC1C2
InChIInChI=1S/C15H26N2/c1-11-10-17(2)6-5-15(11)16-9-14-8-12-3-4-13(14)7-12/h3-4,11-16H,5-10H2,1-2H3
InChIKeyGPOZWASHTOSNEL-UHFFFAOYSA-N
MW234.39 g/mol
LogP2.13
Rot. Bonds3

About N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine

N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine (PubChem CID 113253498) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine
PubChem CID113253498
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine
SMILESCC1CN(C)CCC1NCC1CC2C=CC1C2
InChIInChI=1S/C15H26N2/c1-11-10-17(2)6-5-15(11)16-9-14-8-12-3-4-13(14)7-12/h3-4,11-16H,5-10H2,1-2H3
InChIKeyGPOZWASHTOSNEL-UHFFFAOYSA-N
XLogP2.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[[(1R,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]methyl]-1-methylpiperidin-4-amine
CID 124527653
1,3-dimethyl-N-(oxetan-3-ylmethyl)piperidin-4-amine
CID 176675930
1,3-dimethyl-N-(3-methylbutyl)piperidin-4-amine
CID 115705278
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1-tert-butylpiperidin-4-amine
CID 54866698
N-(1,4-dithian-2-ylmethyl)-1,3-dimethylpiperidin-4-amine
CID 115727339
2-[(1,3-dimethylpiperidin-4-yl)amino]ethanol
CID 115707421
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-3-(2-methylpiperidin-1-yl)propan-1-amine
CID 43225481
N-[[(1R,2R,4S)-2-bicyclo[2.2.1]hept-5-enyl]methyl]-1-(2-methylsulfonylethyl)piperidin-4-amine
CID 98220464
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-4-fluorooxolan-3-amine
CID 126856369
(2S)-1-[(1,3-dimethylpiperidin-4-yl)amino]propan-2-ol
CID 103906380
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1-(1-cyclopropylpyrrolidin-3-yl)methanamine
CID 60857125
N-(cyclopropylmethyl)-1,4-dimethylpyrrolidin-3-amine
CID 131041729

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine?
The IUPAC name of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine (CID 113253498) is N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine?
The canonical SMILES for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine is CC1CN(C)CCC1NCC1CC2C=CC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine?
The InChIKey is GPOZWASHTOSNEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-11-10-17(2)6-5-15(11)16-9-14-8-12-3-4-13(14)7-12/h3-4,11-16H,5-10H2,1-2H3.
What are the key properties of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine?
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine has a molecular weight of 234.39 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 113253498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).