2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane

C79H166F2N8O4 — CID 163878524

IUPAC2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane
SMILESCC(C)C.CC(C)C(C)(C)C.CC(C)C(C)(C)N1CC(F)(F)C1.CC(C)C(C)(C)N1CC2CC(C1)O2.CC(C)C(C)(C)N1CCN(C)CC1.CC(C)C(C)(C)N1CCNC(=O)C1.CC(C)C(C)(C)N1CCOCC1.CC(C)C(C)C.CC1CN(C(C)(C)C(C)C)CCO1
InChIInChI=1S/C11H24N2.C11H21NO.C11H23NO.C10H20N2O.C10H21NO.C9H17F2N.C7H16.C6H14.C4H10/c1-10(2)11(3,4)13-8-6-12(5)7-9-13;1-8(2)11(3,4)12-6-9-5-10(7-12)13-9;1-9(2)11(4,5)12-6-7-13-10(3)8-12;1-8(2)10(3,4)12-6-5-11-9(13)7-12;1-9(2)10(3,4)11-5-7-12-8-6-11;1-7(2)8(3,4)12-5-9(10,11)6-12;1-6(2)7(3,4)5;1-5(2)6(3)4;1-4(2)3/h10H,6-9H2,1-5H3;8-10H,5-7H2,1-4H3;9-10H,6-8H2,1-5H3;8H,5-7H2,1-4H3,(H,11,13);9H,5-8H2,1-4H3;7H,5-6H2,1-4H3;6H,1-5H3;5-6H,1-4H3;4H,1-3H3
InChIKeyPRAWREXTCJVSTE-UHFFFAOYSA-N
MW1330.24 g/mol
LogP17.33
Rot. Bonds13

About 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane

2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane (PubChem CID 163878524) has the molecular formula C79H166F2N8O4 and a molecular weight of 1330.24 g/mol. Its IUPAC name is 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane.

Molecular Properties

Compound Name2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane
PubChem CID163878524
Molecular FormulaC79H166F2N8O4
Molecular Weight1330.24 g/mol
Exact Mass1329.30
IUPAC Name2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane
SMILESCC(C)C.CC(C)C(C)(C)C.CC(C)C(C)(C)N1CC(F)(F)C1.CC(C)C(C)(C)N1CC2CC(C1)O2.CC(C)C(C)(C)N1CCN(C)CC1.CC(C)C(C)(C)N1CCNC(=O)C1.CC(C)C(C)(C)N1CCOCC1.CC(C)C(C)C.CC1CN(C(C)(C)C(C)C)CCO1
InChIInChI=1S/C11H24N2.C11H21NO.C11H23NO.C10H20N2O.C10H21NO.C9H17F2N.C7H16.C6H14.C4H10/c1-10(2)11(3,4)13-8-6-12(5)7-9-13;1-8(2)11(3,4)12-6-9-5-10(7-12)13-9;1-9(2)11(4,5)12-6-7-13-10(3)8-12;1-8(2)10(3,4)12-6-5-11-9(13)7-12;1-9(2)10(3,4)11-5-7-12-8-6-11;1-7(2)8(3,4)12-5-9(10,11)6-12;1-6(2)7(3,4)5;1-5(2)6(3)4;1-4(2)3/h10H,6-9H2,1-5H3;8-10H,5-7H2,1-4H3;9-10H,6-8H2,1-5H3;8H,5-7H2,1-4H3,(H,11,13);9H,5-8H2,1-4H3;7H,5-6H2,1-4H3;6H,1-5H3;5-6H,1-4H3;4H,1-3H3
InChIKeyPRAWREXTCJVSTE-UHFFFAOYSA-N
XLogP17.33
TPSA79.47 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds13
Heavy Atoms93
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001330.24
LogP ≤ 517.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Analyze 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane with MolForge

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Related Compounds

2-tert-butyl-2,6-diazaspiro[3.3]heptane;2-tert-butyl-6,6-difluoro-2-azaspiro[3.3]heptane;4-tert-butylmorpholine;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;7-tert-butyl-2-oxa-7-azaspiro[3.5]nonane;7-tert-butyl-2-oxa-7-azaspiro[3.4]octane;4-tert-butylpiperazin-2-one;2-(1-tert-butylpiperidin-4-yl)-N,N-dimethylethanamine;4-[2-(1-tert-butylpiperidin-4-yl)ethyl]morpholine;1-tert-butyl-4-(2-pyrrolidin-1-ylethyl)piperazine;N,N,2-trimethylpropan-2-amine
CID 157871194
N,N-diethyl-2,3-dimethylbutan-2-amine;2,2-diethyl-3-methylbutan-1-ol;2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;N-(2,3-dimethylbutan-2-yl)-N-methylcyclobutanamine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2,3-dimethyl-N-propan-2-ylbutan-2-amine;2-ethoxy-2,3-dimethylbutane;N-(2-methoxyethyl)-2,3-dimethylbutan-2-amine;2-methylpropane;3-propan-2-ylpentane-1,5-diol;N,N,2,3-tetramethylbutan-2-amine;2,2,3-trimethylbutane;2,3,3-trimethylhexane
CID 162157966
2-(2,2-Dimethylpropyl)-5,5-dimethylmorpholine;3-fluoro-1-methyl-3-(2-methylpropyl)azetidine;1-(2-methoxyethyl)-4-(3-methylbutyl)piperidine;1-(2-methoxyethyl)-3-methyl-3-(2-methylpropyl)azetidine;4-(3-methylbutyl)piperazin-2-one;1-methyl-4-(3-methylbutyl)piperidine;1-[3-methyl-3-(2-methylpropyl)azetidin-1-yl]ethanone;1-[3-(2-methylpropyl)azetidin-1-yl]ethanone
CID 158334541
2-(2,2-Dimethylpropyl)-5,5-dimethylmorpholine;3-fluoro-1-methyl-3-(2-methylpropyl)azetidine;1-(2-methoxyethyl)-4-(3-methylbutyl)piperazine;1-(2-methoxyethyl)-3-methyl-3-(2-methylpropyl)azetidine;4-(3-methylbutyl)piperazin-2-one;1-methyl-4-(3-methylbutyl)piperidine;1-[3-methyl-3-(2-methylpropyl)azetidin-1-yl]ethanone;1-[3-(2-methylpropyl)azetidin-1-yl]ethanone
CID 160613728
2-(2,2-Dimethylpropyl)-5,5-dimethylmorpholine;4-(2,2-dimethylpropyl)-1-(2-methoxyethyl)piperidine;3-fluoro-1-methyl-3-(2-methylpropyl)azetidine;1-(2-methoxyethyl)-4-(3-methylbutyl)piperidine;1-(2-methoxyethyl)-3-methyl-3-(2-methylpropyl)azetidine;4-(3-methylbutyl)piperazin-2-one;1-methyl-4-(3-methylbutyl)piperidine;1-[3-methyl-3-(2-methylpropyl)azetidin-1-yl]ethanone;1-[3-(2-methylpropyl)azetidin-1-yl]ethanone
CID 161108871

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane?
The IUPAC name of 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane (CID 163878524) is 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane.
What is the SMILES notation for 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane?
The canonical SMILES for 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane is CC(C)C.CC(C)C(C)(C)C.CC(C)C(C)(C)N1CC(F)(F)C1.CC(C)C(C)(C)N1CC2CC(C1)O2.CC(C)C(C)(C)N1CCN(C)CC1.CC(C)C(C)(C)N1CCNC(=O)C1.CC(C)C(C)(C)N1CCOCC1.CC(C)C(C)C.CC1CN(C(C)(C)C(C)C)CCO1.
What is the InChIKey of 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane?
The InChIKey is PRAWREXTCJVSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2.C11H21NO.C11H23NO.C10H20N2O.C10H21NO.C9H17F2N.C7H16.C6H14.C4H10/c1-10(2)11(3,4)13-8-6-12(5)7-9-13;1-8(2)11(3,4)12-6-9-5-10(7-12)13-9;1-9(2)11(4,5)12-6-7-13-10(3)8-12;1-8(2)10(3,4)12-6-5-11-9(13)7-12;1-9(2)10(3,4)11-5-7-12-8-6-11;1-7(2)8(3,4)12-5-9(10,11)6-12;1-6(2)7(3,4)5;1-5(2)6(3)4;1-4(2)3/h10H,6-9H2,1-5H3;8-10H,5-7H2,1-4H3;9-10H,6-8H2,1-5H3;8H,5-7H2,1-4H3,(H,11,13);9H,5-8H2,1-4H3;7H,5-6H2,1-4H3;6H,1-5H3;5-6H,1-4H3;4H,1-3H3.
What are the key properties of 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane?
2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane has a molecular weight of 1330.24 g/mol, XLogP of 17.33, 13 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutane;1-(2,3-dimethylbutan-2-yl)-3,3-difluoroazetidine;4-(2,3-dimethylbutan-2-yl)-2-methylmorpholine;1-(2,3-dimethylbutan-2-yl)-4-methylpiperazine;4-(2,3-dimethylbutan-2-yl)morpholine;3-(2,3-dimethylbutan-2-yl)-6-oxa-3-azabicyclo[3.1.1]heptane;4-(2,3-dimethylbutan-2-yl)piperazin-2-one;2-methylpropane;2,2,3-trimethylbutane is sourced from PubChem (CID 163878524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).