1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine

C11H20N2 — CID 79558497

IUPAC1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine
SMILESNC1CN(CC2CC3CCC2C3)C1
InChIInChI=1S/C11H20N2/c12-11-6-13(7-11)5-10-4-8-1-2-9(10)3-8/h8-11H,1-7,12H2
InChIKeyFQDCRXUYDIXLOB-UHFFFAOYSA-N
MW180.29 g/mol
LogP1.07
Rot. Bonds2

About 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine

1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine (PubChem CID 79558497) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine.

Molecular Properties

Compound Name1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine
PubChem CID79558497
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine
SMILESNC1CN(CC2CC3CCC2C3)C1
InChIInChI=1S/C11H20N2/c12-11-6-13(7-11)5-10-4-8-1-2-9(10)3-8/h8-11H,1-7,12H2
InChIKeyFQDCRXUYDIXLOB-UHFFFAOYSA-N
XLogP1.07
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3aR,6aS)-5-(2-bicyclo[2.2.1]heptanylmethyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;hydrochloride
CID 120660823
1-(2-bicyclo[2.2.1]heptanylmethyl)-3,7-dimethyl-1,5-diazocane
CID 63684288
1-(2-bicyclo[2.2.1]heptanylmethyl)pyrrolidin-3-ol
CID 79563086
2-[1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-yl]propanoic acid
CID 116683695
1-(2-bicyclo[2.2.1]heptanylmethyl)-5-methylpiperidine-3-carboxylic acid
CID 122121229
1-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-4-yl]-N-methylmethanamine
CID 79552323
1-(2-bicyclo[2.2.1]heptanylmethyl)-4,6-dimethyl-1,5-diazocane
CID 63687029
(1S,2S,4R)-2-[2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]bicyclo[2.2.1]heptane
CID 54589598
1-(2-bicyclo[2.2.1]heptanylmethyl)-4-(1-chloroethyl)piperidine
CID 106838166
1-(2-bicyclo[2.2.1]heptanylmethyl)-4-(1-bromoethyl)piperidine
CID 106838393
2-(2-bicyclo[2.2.1]heptanyl)-1,1-difluoroethanethiol
CID 88533788
1-[[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]methyl]pyrrolidine-2,5-dione
CID 98186318

Frequently Asked Questions

What is the IUPAC name of 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine?
The IUPAC name of 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine (CID 79558497) is 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine.
What is the SMILES notation for 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine?
The canonical SMILES for 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine is NC1CN(CC2CC3CCC2C3)C1.
What is the InChIKey of 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine?
The InChIKey is FQDCRXUYDIXLOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c12-11-6-13(7-11)5-10-4-8-1-2-9(10)3-8/h8-11H,1-7,12H2.
What are the key properties of 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine?
1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine has a molecular weight of 180.29 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine is sourced from PubChem (CID 79558497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).