10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane

C13H26N2 — CID 176748103

IUPAC10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane
SMILESCC(C)N1CC2CCCCC(C1)N(C)C2
InChIInChI=1S/C13H26N2/c1-11(2)15-9-12-6-4-5-7-13(10-15)14(3)8-12/h11-13H,4-10H2,1-3H3
InChIKeyXECINOIEESEZRL-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.20
Rot. Bonds1

About 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane

10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane (PubChem CID 176748103) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane.

Molecular Properties

Compound Name10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane
PubChem CID176748103
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane
SMILESCC(C)N1CC2CCCCC(C1)N(C)C2
InChIInChI=1S/C13H26N2/c1-11(2)15-9-12-6-4-5-7-13(10-15)14(3)8-12/h11-13H,4-10H2,1-3H3
InChIKeyXECINOIEESEZRL-UHFFFAOYSA-N
XLogP2.20
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

11-propan-2-yl-8-oxa-11-azabicyclo[4.3.3]dodecane
CID 167139033
10-tert-butyl-8-propan-2-yl-8,10-diazabicyclo[4.3.1]decane;methane
CID 160947878
ethane;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole
CID 159480431
3-propan-2-yl-3-azabicyclo[4.3.1]decane
CID 121313326
8-(3-methylbutyl)-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane
CID 168740580
cyclohexyl-(3-propan-2-yl-3,6-diazabicyclo[3.1.1]heptan-6-yl)methanone
CID 134506567
4-ethyl-2-propan-2-yl-3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepine
CID 123656866
11-methyl-11-azabicyclo[4.4.1]undecane
CID 580203
(8aR)-2-propan-2-yl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;ethane
CID 161281609
ethane;2-propan-2-yl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 145315776
cyclobutyl-(3-propan-2-yl-3,6-diazabicyclo[3.1.1]heptan-6-yl)methanone
CID 134506569
ethane;methane;2-propan-2-yl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 160550613

Frequently Asked Questions

What is the IUPAC name of 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane?
The IUPAC name of 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane (CID 176748103) is 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane.
What is the SMILES notation for 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane?
The canonical SMILES for 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane is CC(C)N1CC2CCCCC(C1)N(C)C2.
What is the InChIKey of 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane?
The InChIKey is XECINOIEESEZRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11(2)15-9-12-6-4-5-7-13(10-15)14(3)8-12/h11-13H,4-10H2,1-3H3.
What are the key properties of 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane?
10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane has a molecular weight of 210.36 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-8-propan-2-yl-8,10-diazabicyclo[4.3.2]undecane is sourced from PubChem (CID 176748103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).