1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine

C15H34N2O2 — CID 82953132

IUPAC1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine
SMILESCCOCCN(CCOCC)C(C)CNC(C)(C)C
InChIInChI=1S/C15H34N2O2/c1-7-18-11-9-17(10-12-19-8-2)14(3)13-16-15(4,5)6/h14,16H,7-13H2,1-6H3
InChIKeyHWSKUDIFTBFDSJ-UHFFFAOYSA-N
MW274.45 g/mol
LogP2.14
Rot. Bonds11

About 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine

1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine (PubChem CID 82953132) has the molecular formula C15H34N2O2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine
PubChem CID82953132
Molecular FormulaC15H34N2O2
Molecular Weight274.45 g/mol
Exact Mass274.26
IUPAC Name1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine
SMILESCCOCCN(CCOCC)C(C)CNC(C)(C)C
InChIInChI=1S/C15H34N2O2/c1-7-18-11-9-17(10-12-19-8-2)14(3)13-16-15(4,5)6/h14,16H,7-13H2,1-6H3
InChIKeyHWSKUDIFTBFDSJ-UHFFFAOYSA-N
XLogP2.14
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
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

2-N-(2-ethoxyethyl)-2-N-ethyl-1-N-(2-methylbutan-2-yl)propane-1,2-diamine
CID 63691618
1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-prop-2-enylpropane-1,2-diamine
CID 103340233
4-[bis(2-ethoxyethyl)amino]-2-(ethylamino)-2-methylpentan-1-ol
CID 82944529
1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine
CID 62447273
1-(tert-butylamino)-3-[2-ethoxyethyl(ethyl)amino]propan-2-ol
CID 115475349
1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-pentan-3-ylpropane-1,2-diamine
CID 55072209
N-tert-butyl-N'-(2-methoxyethyl)-2-methyl-N'-pentan-3-ylpropane-1,3-diamine
CID 55072257
2-N,2-N-bis(2-ethoxyethyl)-3-methyl-1-N-propylbutane-1,2-diamine
CID 82952256
ethyl 3-[bis(2-ethoxyethyl)amino]butanoate
CID 82951064
N-(2-bromoethyl)-N-(2-ethoxyethyl)propan-2-amine
CID 80670199
1-(tert-butylamino)-3-ethoxypropan-2-ol
CID 63933571
N-[2-[2-(diethylamino)ethoxy]propyl]-2-methylpropan-2-amine
CID 62460409

Frequently Asked Questions

What is the IUPAC name of 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine?
The IUPAC name of 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine (CID 82953132) is 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine.
What is the SMILES notation for 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine?
The canonical SMILES for 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine is CCOCCN(CCOCC)C(C)CNC(C)(C)C.
What is the InChIKey of 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine?
The InChIKey is HWSKUDIFTBFDSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2O2/c1-7-18-11-9-17(10-12-19-8-2)14(3)13-16-15(4,5)6/h14,16H,7-13H2,1-6H3.
What are the key properties of 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine?
1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine has a molecular weight of 274.45 g/mol, XLogP of 2.14, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-tert-butyl-2-N,2-N-bis(2-ethoxyethyl)propane-1,2-diamine is sourced from PubChem (CID 82953132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).