2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine

C15H34N2O2 — CID 83046420

IUPAC2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine
SMILESCCCC(CNCC)N(CCOCC)CCOCC
InChIInChI=1S/C15H34N2O2/c1-5-9-15(14-16-6-2)17(10-12-18-7-3)11-13-19-8-4/h15-16H,5-14H2,1-4H3
InChIKeyPMEPUILVVYPPRN-UHFFFAOYSA-N
MW274.45 g/mol
LogP2.14
Rot. Bonds14

About 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine

2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine (PubChem CID 83046420) has the molecular formula C15H34N2O2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine
PubChem CID83046420
Molecular FormulaC15H34N2O2
Molecular Weight274.45 g/mol
Exact Mass274.26
IUPAC Name2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine
SMILESCCCC(CNCC)N(CCOCC)CCOCC
InChIInChI=1S/C15H34N2O2/c1-5-9-15(14-16-6-2)17(10-12-18-7-3)11-13-19-8-4/h15-16H,5-14H2,1-4H3
InChIKeyPMEPUILVVYPPRN-UHFFFAOYSA-N
XLogP2.14
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-N,2-N,2-N-triethylpentane-1,2-diamine
CID 83043312
2-N-butyl-1-N,2-N-diethylpentane-1,2-diamine
CID 83043720
1-N-ethyl-2-N-fluoro-2-N-propylpentane-1,2-diamine
CID 162382785
2-N,2-N-bis(2-ethoxyethyl)-3-methyl-1-N-propylbutane-1,2-diamine
CID 82952256
3-N-(2-ethoxyethyl)-3-N-ethyl-1-N-propylbutane-1,3-diamine
CID 63692329
2-N,2-N-bis(2-ethoxyethyl)octane-1,2-diamine
CID 82965560
1-N,2-N-diethyl-2-N-(2-ethylbutyl)pentane-1,2-diamine
CID 83054107
2-N-cyclopropyl-1-N,2-N-diethylpentane-1,2-diamine
CID 83054723
5-ethoxy-N-ethyl-2-methylpentan-1-amine
CID 64665808
1-N-ethyl-2-N-methyl-2-N-(2-methylsulfanylethyl)pentane-1,2-diamine
CID 112665676
6-ethoxy-N-ethyl-2,3-dimethylhexan-1-amine
CID 81015252
2-N,2-N-bis(2-ethoxyethyl)-4-methylsulfanylbutane-1,2-diamine
CID 82965661

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine?
The IUPAC name of 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine (CID 83046420) is 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine.
What is the SMILES notation for 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine?
The canonical SMILES for 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine is CCCC(CNCC)N(CCOCC)CCOCC.
What is the InChIKey of 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine?
The InChIKey is PMEPUILVVYPPRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2O2/c1-5-9-15(14-16-6-2)17(10-12-18-7-3)11-13-19-8-4/h15-16H,5-14H2,1-4H3.
What are the key properties of 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine?
2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine has a molecular weight of 274.45 g/mol, XLogP of 2.14, 14 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-bis(2-ethoxyethyl)-1-N-ethylpentane-1,2-diamine is sourced from PubChem (CID 83046420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).