1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine

C15H35N3 — CID 174059881

IUPAC1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine
SMILESCCN(CC)C(CC)(N(CC)CC)N(CC)CC
InChIInChI=1S/C15H35N3/c1-8-15(16(9-2)10-3,17(11-4)12-5)18(13-6)14-7/h8-14H2,1-7H3
InChIKeyAGJYKMINNPOUJH-UHFFFAOYSA-N
MW257.47 g/mol
LogP3.08
Rot. Bonds10

About 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine

1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine (PubChem CID 174059881) has the molecular formula C15H35N3 and a molecular weight of 257.47 g/mol. Its IUPAC name is 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine.

Molecular Properties

Compound Name1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine
PubChem CID174059881
Molecular FormulaC15H35N3
Molecular Weight257.47 g/mol
Exact Mass257.28
IUPAC Name1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine
SMILESCCN(CC)C(CC)(N(CC)CC)N(CC)CC
InChIInChI=1S/C15H35N3/c1-8-15(16(9-2)10-3,17(11-4)12-5)18(13-6)14-7/h8-14H2,1-7H3
InChIKeyAGJYKMINNPOUJH-UHFFFAOYSA-N
XLogP3.08
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.47
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N',1-N',1-N",1-N"-tetraethyl-1-N,1-N-dimethylpropane-1,1,1-triamine
CID 175352703
2-(hydroxymethyl)-2-[2,2,2-tris(diethylamino)ethyl]propane-1,3-diol
CID 175722922
1,2-dibromo-N,N-diethylbutan-2-amine
CID 140548713
N,N,3-triethylhex-4-yn-3-amine
CID 173345718
2-(diethylamino)-2-methylpropane-1,3-diol
CID 21452281
N,N-diethyl-2-methylpropan-2-amine;dimethylsilane
CID 173297747
2-(diethylamino)-2-methylbutanoic acid
CID 43803567
3-N,3-N,3-N',3-N'-tetraethyl-2-silylpent-1-ene-3,3-diamine
CID 173017031
1-amino-1-(diethylamino)ethanol
CID 57324850
1,1-dichloro-N,N-diethyl-2,2-dimethylpropan-1-amine
CID 10013395
N,N,3-triethyldodecan-3-amine
CID 150961559
[ethyl(propyl)amino]methanetriol
CID 169119513

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine?
The IUPAC name of 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine (CID 174059881) is 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine.
What is the SMILES notation for 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine?
The canonical SMILES for 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine is CCN(CC)C(CC)(N(CC)CC)N(CC)CC.
What is the InChIKey of 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine?
The InChIKey is AGJYKMINNPOUJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H35N3/c1-8-15(16(9-2)10-3,17(11-4)12-5)18(13-6)14-7/h8-14H2,1-7H3.
What are the key properties of 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine?
1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine has a molecular weight of 257.47 g/mol, XLogP of 3.08, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine is sourced from PubChem (CID 174059881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).