6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane

C14H26N2 — CID 155097551

IUPAC6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane
SMILESCC(C)C1CC23C(C(C)C)CN2CC(C)N13
InChIInChI=1S/C14H26N2/c1-9(2)12-8-15-7-11(5)16-13(10(3)4)6-14(12,15)16/h9-13H,6-8H2,1-5H3
InChIKeyMHWNCHHKQAKYPM-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.40
Rot. Bonds2

About 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane

6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane (PubChem CID 155097551) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane.

Molecular Properties

Compound Name6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane
PubChem CID155097551
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane
SMILESCC(C)C1CC23C(C(C)C)CN2CC(C)N13
InChIInChI=1S/C14H26N2/c1-9(2)12-8-15-7-11(5)16-13(10(3)4)6-14(12,15)16/h9-13H,6-8H2,1-5H3
InChIKeyMHWNCHHKQAKYPM-UHFFFAOYSA-N
XLogP2.40
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 140958837
CID 140958837
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1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane
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CID 23384810

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane?
The IUPAC name of 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane (CID 155097551) is 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane.
What is the SMILES notation for 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane?
The canonical SMILES for 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane is CC(C)C1CC23C(C(C)C)CN2CC(C)N13.
What is the InChIKey of 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane?
The InChIKey is MHWNCHHKQAKYPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-9(2)12-8-15-7-11(5)16-13(10(3)4)6-14(12,15)16/h9-13H,6-8H2,1-5H3.
What are the key properties of 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane?
6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane has a molecular weight of 222.38 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,8-di(propan-2-yl)-4,7-diazatricyclo[5.2.0.01,4]nonane is sourced from PubChem (CID 155097551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).