1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine

C11H26N2O — CID 62447273

IUPAC1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine
SMILESCOCCN(C)C(C)CNC(C)(C)C
InChIInChI=1S/C11H26N2O/c1-10(9-12-11(2,3)4)13(5)7-8-14-6/h10,12H,7-9H2,1-6H3
InChIKeyXBJPDRZNCWJQJZ-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.34
Rot. Bonds6

About 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine

1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine (PubChem CID 62447273) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine
PubChem CID62447273
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine
SMILESCOCCN(C)C(C)CNC(C)(C)C
InChIInChI=1S/C11H26N2O/c1-10(9-12-11(2,3)4)13(5)7-8-14-6/h10,12H,7-9H2,1-6H3
InChIKeyXBJPDRZNCWJQJZ-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(2-methoxyethyl)-1-N,2-N-dimethylpropane-1,2-diamine
CID 62447079
1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-pentan-3-ylpropane-1,2-diamine
CID 55072209
1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-prop-2-enylpropane-1,2-diamine
CID 103340233
2-N-(2-methoxyethyl)-2-N-methyl-1-N-prop-2-ynylpropane-1,2-diamine
CID 62569259
N-tert-butyl-N'-(2-methoxyethyl)-2-methyl-N'-pentan-3-ylpropane-1,3-diamine
CID 55072257
1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine
CID 82953132
N-tert-butyl-N'-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine
CID 62429784
N-tert-butyl-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 61427619
N-[2-(2-methoxyethoxy)propyl]-2-methylpropan-2-amine
CID 62457300
2-N-methyl-1-N-(2-methylbutan-2-yl)-2-N-propylpropane-1,2-diamine
CID 62568783
1-N-tert-butyl-2-N,2-N-dibutyl-3-methoxypropane-1,2-diamine
CID 103225490
1-N-ethyl-2-N-(3-methoxypropyl)-2-N-methylpropane-1,2-diamine
CID 63008673

Frequently Asked Questions

What is the IUPAC name of 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine?
The IUPAC name of 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine (CID 62447273) is 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine.
What is the SMILES notation for 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine?
The canonical SMILES for 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine is COCCN(C)C(C)CNC(C)(C)C.
What is the InChIKey of 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine?
The InChIKey is XBJPDRZNCWJQJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-10(9-12-11(2,3)4)13(5)7-8-14-6/h10,12H,7-9H2,1-6H3.
What are the key properties of 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine?
1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine has a molecular weight of 202.34 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine is sourced from PubChem (CID 62447273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).