(2S)-bicyclo[2.2.1]heptan-2-amine

C7H13N — CID 12720689

IUPAC(2S)-bicyclo[2.2.1]heptan-2-amine
SMILESN[C@H]1CC2CCC1C2
InChIInChI=1S/C7H13N/c8-7-4-5-1-2-6(7)3-5/h5-7H,1-4,8H2/t5?,6?,7-/m0/s1
InChIKeyJEPPYVOSGKWVSJ-AHXFUIDQSA-N
MW111.19 g/mol
LogP1.13
Rot. Bonds

About (2S)-bicyclo[2.2.1]heptan-2-amine

(2S)-bicyclo[2.2.1]heptan-2-amine (PubChem CID 12720689) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is (2S)-bicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound Name(2S)-bicyclo[2.2.1]heptan-2-amine
PubChem CID12720689
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name(2S)-bicyclo[2.2.1]heptan-2-amine
SMILESN[C@H]1CC2CCC1C2
InChIInChI=1S/C7H13N/c8-7-4-5-1-2-6(7)3-5/h5-7H,1-4,8H2/t5?,6?,7-/m0/s1
InChIKeyJEPPYVOSGKWVSJ-AHXFUIDQSA-N
XLogP1.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

bicyclo[2.2.1]heptan-2-amine;platinum(2+)
CID 21144668
bicyclo[2.2.2]octan-2-amine
CID 13239288
(2S)-bicyclo[2.2.1]heptan-2-amine;platinum(2+);propan-2-amine;dichloride
CID 56600530
(1S,5R,6R)-bicyclo[3.2.1]octan-6-amine
CID 14638743
(2S)-bicyclo[3.1.1]heptan-2-amine
CID 148819936
2-N-(9-tricyclo[4.3.1.13,8]undecanyl)bicyclo[2.2.2]octane-2,5-diamine
CID 166649485
tricyclo[5.3.2.03,9]dodecan-4-amine
CID 89298731
(1S,2S,4R)-2-[2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]bicyclo[2.2.1]heptane
CID 54589598
tricyclo[5.3.2.04,9]dodecane
CID 54490019
(1R,2S,4R)-2-(iodomethyl)bicyclo[2.2.1]heptane
CID 98085317
2-tricyclo[5.3.1.04,9]undecanylmethanamine
CID 146321194
1-(2-bicyclo[2.2.1]heptanylmethyl)azetidin-3-amine
CID 79558497

Frequently Asked Questions

What is the IUPAC name of (2S)-bicyclo[2.2.1]heptan-2-amine?
The IUPAC name of (2S)-bicyclo[2.2.1]heptan-2-amine (CID 12720689) is (2S)-bicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for (2S)-bicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for (2S)-bicyclo[2.2.1]heptan-2-amine is N[C@H]1CC2CCC1C2.
What is the InChIKey of (2S)-bicyclo[2.2.1]heptan-2-amine?
The InChIKey is JEPPYVOSGKWVSJ-AHXFUIDQSA-N. The full InChI is InChI=1S/C7H13N/c8-7-4-5-1-2-6(7)3-5/h5-7H,1-4,8H2/t5?,6?,7-/m0/s1.
What are the key properties of (2S)-bicyclo[2.2.1]heptan-2-amine?
(2S)-bicyclo[2.2.1]heptan-2-amine has a molecular weight of 111.19 g/mol, XLogP of 1.13, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-bicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 12720689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).