(1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine

C10H20N2 — CID 98053858

IUPAC(1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine
SMILESCC(C)N1C[C@H]2CC[C@H](C1)C2N
InChIInChI=1S/C10H20N2/c1-7(2)12-5-8-3-4-9(6-12)10(8)11/h7-10H,3-6,11H2,1-2H3/t8-,9-/m1/s1
InChIKeySHYSXJBPBGOXED-RKDXNWHRSA-N
MW168.28 g/mol
LogP1.06
Rot. Bonds1

About (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine

(1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine (PubChem CID 98053858) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine.

Molecular Properties

Compound Name(1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine
PubChem CID98053858
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine
SMILESCC(C)N1C[C@H]2CC[C@H](C1)C2N
InChIInChI=1S/C10H20N2/c1-7(2)12-5-8-3-4-9(6-12)10(8)11/h7-10H,3-6,11H2,1-2H3/t8-,9-/m1/s1
InChIKeySHYSXJBPBGOXED-RKDXNWHRSA-N
XLogP1.06
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-amine
CID 67401281
(5R)-2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindol-5-amine
CID 155648643
(3aS,6aR)-2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-amine
CID 153474508
(1S,5S)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol
CID 98053860
ethane;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole
CID 159480431
1-propan-2-ylazetidin-3-amine;hydrochloride
CID 134588428
(6S)-3-propan-2-yl-3-azabicyclo[4.2.0]octane
CID 137467561
2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindol-5-ol
CID 131059460
(1R,5R)-3-propan-2-yl-3-azabicyclo[3.3.1]nonan-9-ol
CID 98053872
5-methyl-2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 129015187
5-propan-2-yl-1,3,3a,4,6,6a-hexahydrothieno[3,4-c]pyrrole
CID 169244946
(3aR,6aS)-5-methyl-2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 166871486

Frequently Asked Questions

What is the IUPAC name of (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine?
The IUPAC name of (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine (CID 98053858) is (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine.
What is the SMILES notation for (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine?
The canonical SMILES for (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine is CC(C)N1C[C@H]2CC[C@H](C1)C2N.
What is the InChIKey of (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine?
The InChIKey is SHYSXJBPBGOXED-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H20N2/c1-7(2)12-5-8-3-4-9(6-12)10(8)11/h7-10H,3-6,11H2,1-2H3/t8-,9-/m1/s1.
What are the key properties of (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine?
(1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine has a molecular weight of 168.28 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5R)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-amine is sourced from PubChem (CID 98053858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).