3-[ethyl(methyl)amino]propan-1-ol

C6H15NO — CID 14440969

IUPAC3-[ethyl(methyl)amino]propan-1-ol
SMILESCCN(C)CCCO
InChIInChI=1S/C6H15NO/c1-3-7(2)5-4-6-8/h8H,3-6H2,1-2H3
InChIKeyTZVYDYIDLQCRHV-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.32
Rot. Bonds4

About 3-[ethyl(methyl)amino]propan-1-ol

3-[ethyl(methyl)amino]propan-1-ol (PubChem CID 14440969) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is 3-[ethyl(methyl)amino]propan-1-ol.

Molecular Properties

Compound Name3-[ethyl(methyl)amino]propan-1-ol
PubChem CID14440969
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Name3-[ethyl(methyl)amino]propan-1-ol
SMILESCCN(C)CCCO
InChIInChI=1S/C6H15NO/c1-3-7(2)5-4-6-8/h8H,3-6H2,1-2H3
InChIKeyTZVYDYIDLQCRHV-UHFFFAOYSA-N
XLogP0.32
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Diethylamino)-1-propanol
CID 12159
3-(Dimethylamino)-1-propanol
CID 76646
1-Propanol, 3-(dibutylamino)-
CID 74905
(3-Hydroxypropyl)trimethylammonium chloride
CID 23168
3-(Diethylamino)-2,2-dimethylpropan-1-ol
CID 295965
3-[Di(propan-2-yl)amino]propan-1-ol
CID 295957
3-(Dimethylamino)-2,2-dimethyl-1-propanol
CID 87919
1-Propanol, 3-(dipropylamino)-
CID 214730
Dimethyl-(2-hydroxyethyl)-(3-hydroxypropyl)ammonium chloride
CID 174113
4-(Dimethylamino)butan-2-ol
CID 10855427
3-((2-(Dimethylamino)ethyl)(methyl)amino)propan-1-ol
CID 547315
Tripropanolamine
CID 9794123

Frequently Asked Questions

What is the IUPAC name of 3-[ethyl(methyl)amino]propan-1-ol?
The IUPAC name of 3-[ethyl(methyl)amino]propan-1-ol (CID 14440969) is 3-[ethyl(methyl)amino]propan-1-ol.
What is the SMILES notation for 3-[ethyl(methyl)amino]propan-1-ol?
The canonical SMILES for 3-[ethyl(methyl)amino]propan-1-ol is CCN(C)CCCO.
What is the InChIKey of 3-[ethyl(methyl)amino]propan-1-ol?
The InChIKey is TZVYDYIDLQCRHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-3-7(2)5-4-6-8/h8H,3-6H2,1-2H3.
What are the key properties of 3-[ethyl(methyl)amino]propan-1-ol?
3-[ethyl(methyl)amino]propan-1-ol has a molecular weight of 117.19 g/mol, XLogP of 0.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl(methyl)amino]propan-1-ol is sourced from PubChem (CID 14440969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).