1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine

C11H22N2O — CID 102651812

IUPAC1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine
SMILESCCC(C)(C(N)C1=CCCO1)N(C)C
InChIInChI=1S/C11H22N2O/c1-5-11(2,13(3)4)10(12)9-7-6-8-14-9/h7,10H,5-6,8,12H2,1-4H3
InChIKeyMRQYRVPBSOGPFL-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.35
Rot. Bonds4

About 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine

1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine (PubChem CID 102651812) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine
PubChem CID102651812
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine
SMILESCCC(C)(C(N)C1=CCCO1)N(C)C
InChIInChI=1S/C11H22N2O/c1-5-11(2,13(3)4)10(12)9-7-6-8-14-9/h7,10H,5-6,8,12H2,1-4H3
InChIKeyMRQYRVPBSOGPFL-UHFFFAOYSA-N
XLogP1.35
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dihydrofuran-5-yl)-2-ethoxy-2-methylpropan-1-amine
CID 102652221
2-(azepan-1-yl)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-amine
CID 102651808
1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-2-methylbutan-1-amine
CID 102648095
1-(2,3-dihydrofuran-5-yl)pentan-1-amine
CID 102651898
1-(2,3-dihydrofuran-5-yl)-3,4,4-trimethylpentan-1-amine
CID 102653140
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine
CID 102647687
1-(2,3-dihydrofuran-5-yl)-2-methyl-2-morpholin-4-ylbutan-1-ol
CID 102654749
1-(2,3-dihydrofuran-5-yl)-3-methylbutan-1-amine
CID 102651213
2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine
CID 79064305
[1-(2,3-dihydrofuran-5-yl)-2-methyl-2-morpholin-4-ylbutyl]hydrazine
CID 102654226
1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)-2-methylpropan-1-ol
CID 102654733
1-(2,6-difluorophenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 79063864

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine (CID 102651812) is 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine is CCC(C)(C(N)C1=CCCO1)N(C)C.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine?
The InChIKey is MRQYRVPBSOGPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-5-11(2,13(3)4)10(12)9-7-6-8-14-9/h7,10H,5-6,8,12H2,1-4H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine?
1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine has a molecular weight of 198.31 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine is sourced from PubChem (CID 102651812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).