2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine

C15H34N2O — CID 54986885

IUPAC2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine
SMILESCCCC(CN)(CCC)N(CCOC)CC(C)C
InChIInChI=1S/C15H34N2O/c1-6-8-15(13-16,9-7-2)17(10-11-18-5)12-14(3)4/h14H,6-13,16H2,1-5H3
InChIKeyAAOZOKZGSGDXNU-UHFFFAOYSA-N
MW258.45 g/mol
LogP2.89
Rot. Bonds11

About 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine

2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine (PubChem CID 54986885) has the molecular formula C15H34N2O and a molecular weight of 258.45 g/mol. Its IUPAC name is 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine.

Molecular Properties

Compound Name2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine
PubChem CID54986885
Molecular FormulaC15H34N2O
Molecular Weight258.45 g/mol
Exact Mass258.27
IUPAC Name2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine
SMILESCCCC(CN)(CCC)N(CCOC)CC(C)C
InChIInChI=1S/C15H34N2O/c1-6-8-15(13-16,9-7-2)17(10-11-18-5)12-14(3)4/h14H,6-13,16H2,1-5H3
InChIKeyAAOZOKZGSGDXNU-UHFFFAOYSA-N
XLogP2.89
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine?
The IUPAC name of 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine (CID 54986885) is 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine.
What is the SMILES notation for 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine?
The canonical SMILES for 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine is CCCC(CN)(CCC)N(CCOC)CC(C)C.
What is the InChIKey of 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine?
The InChIKey is AAOZOKZGSGDXNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2O/c1-6-8-15(13-16,9-7-2)17(10-11-18-5)12-14(3)4/h14H,6-13,16H2,1-5H3.
What are the key properties of 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine?
2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine has a molecular weight of 258.45 g/mol, XLogP of 2.89, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2-propylpentane-1,2-diamine is sourced from PubChem (CID 54986885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).