13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene

C15H28N2 — CID 91061874

IUPAC13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene
SMILESCC1=CN2CCCCCCCCCCN1C2C
InChIInChI=1S/C15H28N2/c1-14-13-16-11-9-7-5-3-4-6-8-10-12-17(14)15(16)2/h13,15H,3-12H2,1-2H3
InChIKeyJQZVAQCMBZMQSG-UHFFFAOYSA-N
MW236.40 g/mol
LogP3.95
Rot. Bonds

About 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene

13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene (PubChem CID 91061874) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene.

Molecular Properties

Compound Name13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene
PubChem CID91061874
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC Name13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene
SMILESCC1=CN2CCCCCCCCCCN1C2C
InChIInChI=1S/C15H28N2/c1-14-13-16-11-9-7-5-3-4-6-8-10-12-17(14)15(16)2/h13,15H,3-12H2,1-2H3
InChIKeyJQZVAQCMBZMQSG-UHFFFAOYSA-N
XLogP3.95
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Octyl-3-methyl imidazole
CID 21321822
1-methyl-3-nonyl-2H-imidazole
CID 17865358
1-Decyl-3-methylimidazole
CID 18513308
1,2-Dimethyl-3 decylimidazole
CID 21567448
1-octyl-3-propyl-2H-imidazole
CID 23148549
1-Allyl-3-octylimidazole
CID 23154616
1-ethenyl-3-octyl-2H-imidazole
CID 117890583
1-Decyl-2,3-dimethylimidazole hydrobromide
CID 141760895
1-decyl-3-ethyl-2H-imidazole
CID 19864130
1,2-dimethyl-3-octyl-2H-imidazole
CID 21321802
1-ethyl-3-octyl-2H-imidazole
CID 21321806
1,4,5-trimethyl-3-octyl-2H-imidazole
CID 21321827

Frequently Asked Questions

What is the IUPAC name of 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene?
The IUPAC name of 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene (CID 91061874) is 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene.
What is the SMILES notation for 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene?
The canonical SMILES for 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene is CC1=CN2CCCCCCCCCCN1C2C.
What is the InChIKey of 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene?
The InChIKey is JQZVAQCMBZMQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-14-13-16-11-9-7-5-3-4-6-8-10-12-17(14)15(16)2/h13,15H,3-12H2,1-2H3.
What are the key properties of 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene?
13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene has a molecular weight of 236.40 g/mol, XLogP of 3.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 13,15-dimethyl-1,12-diazabicyclo[10.2.1]pentadec-13-ene is sourced from PubChem (CID 91061874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).