8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane

C13H24N2 — CID 166643950

IUPAC8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane
SMILESCC(C)CN1CC2CC3CC1C2C(C)N3
InChIInChI=1S/C13H24N2/c1-8(2)6-15-7-10-4-11-5-12(15)13(10)9(3)14-11/h8-14H,4-7H2,1-3H3
InChIKeyAZEDOAVHAKEBDB-UHFFFAOYSA-N
MW208.35 g/mol
LogP1.71
Rot. Bonds2

About 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane

8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane (PubChem CID 166643950) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane.

Molecular Properties

Compound Name8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane
PubChem CID166643950
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane
SMILESCC(C)CN1CC2CC3CC1C2C(C)N3
InChIInChI=1S/C13H24N2/c1-8(2)6-15-7-10-4-11-5-12(15)13(10)9(3)14-11/h8-14H,4-7H2,1-3H3
InChIKeyAZEDOAVHAKEBDB-UHFFFAOYSA-N
XLogP1.71
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-methylpropyl)-4,8-diazatricyclo[4.3.1.03,7]decane
CID 166643898
2-cyclohexyl-1-(2-methylpropyl)-5-propylpiperazine
CID 64838406
2,4-dimethyl-3-(2-methylpropyl)-3,8-diazabicyclo[3.2.1]oct-6-ene
CID 144662393
(1S,5R)-2-(2-methylpropyl)-2-azabicyclo[3.1.0]hexane
CID 167420955
(3S,5S)-1-(2-methylpropyl)-5-propylpyrrolidin-3-ol
CID 99995289
2,5-bis(2-methylpropyl)-2,5-diazabicyclo[2.2.2]octane
CID 129193409
(1S,2R,5S)-2-methyl-7-(2-methylpropyl)-3,7-diazabicyclo[3.3.1]nonane
CID 129373109
3,5-dimethyl-1-(2-methylpropyl)piperidine
CID 20562086
5-ethyl-1-(2-methylpropyl)-2-propylpiperazine
CID 64842892
5-tert-butyl-2-cyclohexyl-1-(2-methylpropyl)piperazine
CID 64842807
(2S)-2,4-dimethyl-1-(2-methylpropyl)piperazine
CID 171515421
3-methyl-2-azabicyclo[2.2.1]heptane
CID 20805027

Frequently Asked Questions

What is the IUPAC name of 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane?
The IUPAC name of 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane (CID 166643950) is 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane.
What is the SMILES notation for 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane?
The canonical SMILES for 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane is CC(C)CN1CC2CC3CC1C2C(C)N3.
What is the InChIKey of 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane?
The InChIKey is AZEDOAVHAKEBDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-8(2)6-15-7-10-4-11-5-12(15)13(10)9(3)14-11/h8-14H,4-7H2,1-3H3.
What are the key properties of 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane?
8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane has a molecular weight of 208.35 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-4-(2-methylpropyl)-4,9-diazatricyclo[4.3.1.03,7]decane is sourced from PubChem (CID 166643950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).