2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine

C15H28N2 — CID 79558165

IUPAC2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine
SMILESNCCC1CCCCN1CC1CC2CCC1C2
InChIInChI=1S/C15H28N2/c16-7-6-15-3-1-2-8-17(15)11-14-10-12-4-5-13(14)9-12/h12-15H,1-11,16H2
InChIKeyVJMIUOGXNDUGRK-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.63
Rot. Bonds4

About 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine

2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine (PubChem CID 79558165) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine
PubChem CID79558165
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC Name2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine
SMILESNCCC1CCCCN1CC1CC2CCC1C2
InChIInChI=1S/C15H28N2/c16-7-6-15-3-1-2-8-17(15)11-14-10-12-4-5-13(14)9-12/h12-15H,1-11,16H2
InChIKeyVJMIUOGXNDUGRK-UHFFFAOYSA-N
XLogP2.63
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-(2-bicyclo[2.2.1]heptanylmethyl)-2-(chloromethyl)pyrrolidine
CID 164644249
1-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carbaldehyde
CID 79563432
1-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxylic acid
CID 79558379
2-[1-(2-fluoroethyl)piperidin-2-yl]ethanamine
CID 80695108
(4aR,8aR)-4-[[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazine
CID 124728902
(1S,2S,4R)-2-[2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]bicyclo[2.2.1]heptane
CID 54589598
2-(1-hexylpiperidin-2-yl)ethanamine
CID 63759699
2-[1-(3,3-difluorobutyl)piperidin-2-yl]ethanamine
CID 84685954
2-[1-[2-(diethylamino)ethyl]piperidin-2-yl]ethanamine
CID 63760471
1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine
CID 79558497
2-[4-(2-bicyclo[2.2.1]heptanylmethyl)-1,1-dioxo-1,4-thiazinan-3-yl]acetic acid
CID 80520271
2-[1-(3,3-difluorobutyl)azepan-2-yl]ethanamine
CID 84697916

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine?
The IUPAC name of 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine (CID 79558165) is 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine.
What is the SMILES notation for 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine?
The canonical SMILES for 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine is NCCC1CCCCN1CC1CC2CCC1C2.
What is the InChIKey of 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine?
The InChIKey is VJMIUOGXNDUGRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c16-7-6-15-3-1-2-8-17(15)11-14-10-12-4-5-13(14)9-12/h12-15H,1-11,16H2.
What are the key properties of 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine?
2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine has a molecular weight of 236.40 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-2-yl]ethanamine is sourced from PubChem (CID 79558165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).