(2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane

C8H14N2 — CID 167165495

IUPAC(2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane
SMILESC1CC2NC1[C@H]1CNC[C@@H]21
InChIInChI=1S/C8H14N2/c1-2-8-6-4-9-3-5(6)7(1)10-8/h5-10H,1-4H2/t5-,6+,7?,8?
InChIKeySWSHTPYCZICGDC-XEDAXZNXSA-N
MW138.21 g/mol
LogP-0.04
Rot. Bonds

About (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane

(2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane (PubChem CID 167165495) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane.

Molecular Properties

Compound Name(2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane
PubChem CID167165495
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane
SMILESC1CC2NC1[C@H]1CNC[C@@H]21
InChIInChI=1S/C8H14N2/c1-2-8-6-4-9-3-5(6)7(1)10-8/h5-10H,1-4H2/t5-,6+,7?,8?
InChIKeySWSHTPYCZICGDC-XEDAXZNXSA-N
XLogP-0.04
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane?
The IUPAC name of (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane (CID 167165495) is (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane.
What is the SMILES notation for (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane?
The canonical SMILES for (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane is C1CC2NC1[C@H]1CNC[C@@H]21.
What is the InChIKey of (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane?
The InChIKey is SWSHTPYCZICGDC-XEDAXZNXSA-N. The full InChI is InChI=1S/C8H14N2/c1-2-8-6-4-9-3-5(6)7(1)10-8/h5-10H,1-4H2/t5-,6+,7?,8?.
What are the key properties of (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane?
(2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane has a molecular weight of 138.21 g/mol, XLogP of -0.04, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-4,10-diazatricyclo[5.2.1.02,6]decane is sourced from PubChem (CID 167165495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).