2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine

C14H32N2O2 — CID 107473244

IUPAC2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine
SMILESCOCCN(CCOC)CC(CN)CC(C)(C)C
InChIInChI=1S/C14H32N2O2/c1-14(2,3)10-13(11-15)12-16(6-8-17-4)7-9-18-5/h13H,6-12,15H2,1-5H3
InChIKeyCXLGEYYLRQZLKR-UHFFFAOYSA-N
MW260.42 g/mol
LogP1.59
Rot. Bonds10

About 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine

2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine (PubChem CID 107473244) has the molecular formula C14H32N2O2 and a molecular weight of 260.42 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine
PubChem CID107473244
Molecular FormulaC14H32N2O2
Molecular Weight260.42 g/mol
Exact Mass260.25
IUPAC Name2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine
SMILESCOCCN(CCOC)CC(CN)CC(C)(C)C
InChIInChI=1S/C14H32N2O2/c1-14(2,3)10-13(11-15)12-16(6-8-17-4)7-9-18-5/h13H,6-12,15H2,1-5H3
InChIKeyCXLGEYYLRQZLKR-UHFFFAOYSA-N
XLogP1.59
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,2-dimethylpropyl)-N'-ethyl-N'-(2-methoxyethyl)propane-1,3-diamine
CID 107473280
N'-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)butane-1,4-diamine
CID 81079086
2-(aminomethyl)-N-(2-methoxyethyl)-4,4-dimethyl-N-propan-2-ylpentanamide
CID 107472614
1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol
CID 64822021
1-[bis(2-methoxyethyl)amino]propan-2-ol
CID 59693413
1-amino-3-[ethyl(2-methoxyethyl)amino]propan-2-ol
CID 61447893
N-[2-(2-aminoethoxy)ethyl]-N-(2-methoxyethyl)-2-methylpropan-1-amine
CID 79478302
2-ethyl-N'-(2-methoxyethyl)-N'-propan-2-ylpropane-1,3-diamine
CID 82951118
N'-(2-methoxyethyl)-N'-(2-methylpropyl)heptane-1,7-diamine
CID 54985939
N'-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-N'-methylpropane-1,3-diamine
CID 107473176
N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride
CID 86811567
methyl 3-[bis(2-methoxyethyl)amino]-2-methylpropanoate
CID 60649296

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine?
The IUPAC name of 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine (CID 107473244) is 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine?
The canonical SMILES for 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine is COCCN(CCOC)CC(CN)CC(C)(C)C.
What is the InChIKey of 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine?
The InChIKey is CXLGEYYLRQZLKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O2/c1-14(2,3)10-13(11-15)12-16(6-8-17-4)7-9-18-5/h13H,6-12,15H2,1-5H3.
What are the key properties of 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine?
2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine has a molecular weight of 260.42 g/mol, XLogP of 1.59, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-N',N'-bis(2-methoxyethyl)propane-1,3-diamine is sourced from PubChem (CID 107473244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).