N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine

C12H26N2O — CID 63982239

IUPACN-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine
SMILESCCC(C)(C)N(C)C(CN)C1CCOC1
InChIInChI=1S/C12H26N2O/c1-5-12(2,3)14(4)11(8-13)10-6-7-15-9-10/h10-11H,5-9,13H2,1-4H3
InChIKeyUERWBQXAGJKMJV-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.47
Rot. Bonds5

About N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine

N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine (PubChem CID 63982239) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine
PubChem CID63982239
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine
SMILESCCC(C)(C)N(C)C(CN)C1CCOC1
InChIInChI=1S/C12H26N2O/c1-5-12(2,3)14(4)11(8-13)10-6-7-15-9-10/h10-11H,5-9,13H2,1-4H3
InChIKeyUERWBQXAGJKMJV-UHFFFAOYSA-N
XLogP1.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(2-methylbutan-2-yl)-1-(oxan-3-yl)ethane-1,2-diamine
CID 63983102
N,N-bis(2-methylpropyl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 61377686
1-(oxolan-3-yl)-N,N-dipropylethane-1,2-diamine
CID 16792709
N-(cyclopropylmethyl)-N-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 60984338
N-(2-methylpropyl)-1-(oxolan-3-yl)-N-pentan-3-ylethane-1,2-diamine
CID 79483273
2-(dimethylamino)-2-ethyl-1-(oxolan-3-yl)butan-1-ol
CID 79061948
N-methyl-N-(2-methylpropyl)-1-(oxan-3-yl)ethane-1,2-diamine
CID 63741818
N-methyl-N-(oxan-2-ylmethyl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 61431092
N-methyl-N-(2-methylpropyl)-1-(oxan-4-yl)ethane-1,2-diamine
CID 62386315
2-(2,2-dimethylhydrazinyl)-2-(oxolan-3-yl)ethanamine
CID 83010989
N-cyclopropyl-N-methyl-1-(oxan-4-yl)ethane-1,2-diamine
CID 62384670
3-amino-2-(oxolan-3-yl)propane-1-thiol
CID 117238038

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine?
The IUPAC name of N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine (CID 63982239) is N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine.
What is the SMILES notation for N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine?
The canonical SMILES for N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine is CCC(C)(C)N(C)C(CN)C1CCOC1.
What is the InChIKey of N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine?
The InChIKey is UERWBQXAGJKMJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-12(2,3)14(4)11(8-13)10-6-7-15-9-10/h10-11H,5-9,13H2,1-4H3.
What are the key properties of N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine?
N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine has a molecular weight of 214.35 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylbutan-2-yl)-1-(oxolan-3-yl)ethane-1,2-diamine is sourced from PubChem (CID 63982239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).