6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol

C16H36N2O — CID 64796522

IUPAC6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol
SMILESCCCNC(C)(CO)CCCCN(CCC)CCC
InChIInChI=1S/C16H36N2O/c1-5-11-17-16(4,15-19)10-8-9-14-18(12-6-2)13-7-3/h17,19H,5-15H2,1-4H3
InChIKeyCAYSCUAXSDQGSL-UHFFFAOYSA-N
MW272.48 g/mol
LogP3.03
Rot. Bonds13

About 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol

6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol (PubChem CID 64796522) has the molecular formula C16H36N2O and a molecular weight of 272.48 g/mol. Its IUPAC name is 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol.

Molecular Properties

Compound Name6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol
PubChem CID64796522
Molecular FormulaC16H36N2O
Molecular Weight272.48 g/mol
Exact Mass272.28
IUPAC Name6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol
SMILESCCCNC(C)(CO)CCCCN(CCC)CCC
InChIInChI=1S/C16H36N2O/c1-5-11-17-16(4,15-19)10-8-9-14-18(12-6-2)13-7-3/h17,19H,5-15H2,1-4H3
InChIKeyCAYSCUAXSDQGSL-UHFFFAOYSA-N
XLogP3.03
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.48
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-[ethyl(2-methoxyethyl)amino]-2-methyl-2-(propylamino)hexan-1-ol
CID 64825748
4-[2-(dimethylamino)ethyl-propylamino]-2-methyl-2-(propylamino)butan-1-ol
CID 64790162
6-[2,2-dimethylpropyl(methyl)amino]-2-methyl-2-(propylamino)hexan-1-ol
CID 64825383
4-[3-(diethylamino)propyl-ethylamino]-2-methyl-2-(propylamino)butan-1-ol
CID 102998403
2-(ethylamino)-2-methyl-6-[propyl(2,2,2-trifluoroethyl)amino]hexan-1-ol
CID 64825496
5-[ethyl(2-methoxyethyl)amino]-2-methyl-2-(propylamino)pentan-1-ol
CID 64825355
2-methyl-6-[methyl(2-methylbutyl)amino]-2-(propylamino)hexan-1-ol
CID 64798749
2-methyl-6-[methyl-(4-methylcyclohexyl)amino]-2-(propylamino)hexan-1-ol
CID 64827792
2-methyl-6-[methyl(2-pyrrolidin-1-ylethyl)amino]-2-(propylamino)hexan-1-ol
CID 64791476
2-methyl-6-octoxy-2-(propylamino)hexan-1-ol
CID 64811651
2-(cyclopropylamino)-6-[ethyl(propyl)amino]-2-methylhexan-1-ol
CID 64797663
2-methyl-5-[methyl(2-methylpropyl)amino]-2-(propylamino)pentan-1-ol
CID 64796336

Frequently Asked Questions

What is the IUPAC name of 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol?
The IUPAC name of 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol (CID 64796522) is 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol.
What is the SMILES notation for 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol?
The canonical SMILES for 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol is CCCNC(C)(CO)CCCCN(CCC)CCC.
What is the InChIKey of 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol?
The InChIKey is CAYSCUAXSDQGSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36N2O/c1-5-11-17-16(4,15-19)10-8-9-14-18(12-6-2)13-7-3/h17,19H,5-15H2,1-4H3.
What are the key properties of 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol?
6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol has a molecular weight of 272.48 g/mol, XLogP of 3.03, 13 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol is sourced from PubChem (CID 64796522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).