(1R,6S,7R)-bicyclo[4.2.0]octan-7-amine

C8H15N — CID 124833630

IUPAC(1R,6S,7R)-bicyclo[4.2.0]octan-7-amine
SMILESN[C@@H]1C[C@H]2CCCC[C@@H]21
InChIInChI=1S/C8H15N/c9-8-5-6-3-1-2-4-7(6)8/h6-8H,1-5,9H2/t6-,7+,8-/m1/s1
InChIKeyNTHUTVZYZXXSOR-GJMOJQLCSA-N
MW125.22 g/mol
LogP1.52
Rot. Bonds

About (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine

(1R,6S,7R)-bicyclo[4.2.0]octan-7-amine (PubChem CID 124833630) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine.

Molecular Properties

Compound Name(1R,6S,7R)-bicyclo[4.2.0]octan-7-amine
PubChem CID124833630
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC Name(1R,6S,7R)-bicyclo[4.2.0]octan-7-amine
SMILESN[C@@H]1C[C@H]2CCCC[C@@H]21
InChIInChI=1S/C8H15N/c9-8-5-6-3-1-2-4-7(6)8/h6-8H,1-5,9H2/t6-,7+,8-/m1/s1
InChIKeyNTHUTVZYZXXSOR-GJMOJQLCSA-N
XLogP1.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine with MolForge

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Related Compounds

(1S,7S,8R)-bicyclo[5.2.0]nonan-8-amine;hydrochloride
CID 138987457
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2,3-diamine
CID 18958568
(2S,3S,4aR,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2,3-diamine
CID 102461320
(2S,3S,4aS,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2,3-diamine
CID 102239581
2-cyclohexylcycloheptan-1-amine
CID 62603079
2,3,4,4a,4b,5,6,7,8,8a,9,9a-dodecahydro-1H-fluorene
CID 21972
(1S,2R,6R,7S)-tricyclo[5.2.1.02,6]decan-8-amine
CID 11378594
(1S,7S)-tricyclo[5.2.1.02,6]decan-8-amine
CID 166642246
trans-(1R,2R)-2-cyclohexylcyclopropan-1-amine;hydrochloride
CID 134690804
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-1,6-diamine
CID 67294026
cis-(1S,2R)-2-cyclobutylcyclobutan-1-amine
CID 99715514
[1-(aminomethyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-yl]methanamine
CID 69411723

Frequently Asked Questions

What is the IUPAC name of (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine?
The IUPAC name of (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine (CID 124833630) is (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine.
What is the SMILES notation for (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine?
The canonical SMILES for (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine is N[C@@H]1C[C@H]2CCCC[C@@H]21.
What is the InChIKey of (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine?
The InChIKey is NTHUTVZYZXXSOR-GJMOJQLCSA-N. The full InChI is InChI=1S/C8H15N/c9-8-5-6-3-1-2-4-7(6)8/h6-8H,1-5,9H2/t6-,7+,8-/m1/s1.
What are the key properties of (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine?
(1R,6S,7R)-bicyclo[4.2.0]octan-7-amine has a molecular weight of 125.22 g/mol, XLogP of 1.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,6S,7R)-bicyclo[4.2.0]octan-7-amine is sourced from PubChem (CID 124833630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).