3-[ethyl(nonan-5-yl)amino]propan-1-ol

C14H31NO — CID 88539707

IUPAC3-[ethyl(nonan-5-yl)amino]propan-1-ol
SMILESCCCCC(CCCC)N(CC)CCCO
InChIInChI=1S/C14H31NO/c1-4-7-10-14(11-8-5-2)15(6-3)12-9-13-16/h14,16H,4-13H2,1-3H3
InChIKeyLGPYQWJEKVZCIL-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.44
Rot. Bonds11

About 3-[ethyl(nonan-5-yl)amino]propan-1-ol

3-[ethyl(nonan-5-yl)amino]propan-1-ol (PubChem CID 88539707) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is 3-[ethyl(nonan-5-yl)amino]propan-1-ol.

Molecular Properties

Compound Name3-[ethyl(nonan-5-yl)amino]propan-1-ol
PubChem CID88539707
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC Name3-[ethyl(nonan-5-yl)amino]propan-1-ol
SMILESCCCCC(CCCC)N(CC)CCCO
InChIInChI=1S/C14H31NO/c1-4-7-10-14(11-8-5-2)15(6-3)12-9-13-16/h14,16H,4-13H2,1-3H3
InChIKeyLGPYQWJEKVZCIL-UHFFFAOYSA-N
XLogP3.44
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[ethyl(nonan-5-yl)amino]propan-1-ol 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

4-[ethyl(nonan-5-yl)amino]butan-1-ol
CID 88539737
3-[ethyl(heptan-3-yl)amino]propan-1-ol
CID 88539912
3-[ethyl(pentyl)amino]pentan-1-ol
CID 168878790
1-[ethyl(3-hydroxypropyl)amino]butan-1-ol
CID 90465206
3-[butan-2-yl(ethyl)amino]propan-1-ol
CID 43509660
3-amino-2-[butyl(ethyl)amino]propan-1-ol
CID 104710797
2-[decan-4-yl(2-hydroxyethyl)amino]ethanol
CID 169095504
N,N-diethyltridecan-4-amine
CID 159822270
2-[dodecyl(2-hydroxyethyl)amino]tetracosan-1-ol
CID 157153844
4-(diethylamino)pentan-1-ol
CID 87480053
N,N-dibutyltridecan-4-amine
CID 139649762
2-N-butyl-1-N,2-N-diethylpentane-1,2-diamine
CID 83043720

Frequently Asked Questions

What is the IUPAC name of 3-[ethyl(nonan-5-yl)amino]propan-1-ol?
The IUPAC name of 3-[ethyl(nonan-5-yl)amino]propan-1-ol (CID 88539707) is 3-[ethyl(nonan-5-yl)amino]propan-1-ol.
What is the SMILES notation for 3-[ethyl(nonan-5-yl)amino]propan-1-ol?
The canonical SMILES for 3-[ethyl(nonan-5-yl)amino]propan-1-ol is CCCCC(CCCC)N(CC)CCCO.
What is the InChIKey of 3-[ethyl(nonan-5-yl)amino]propan-1-ol?
The InChIKey is LGPYQWJEKVZCIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-4-7-10-14(11-8-5-2)15(6-3)12-9-13-16/h14,16H,4-13H2,1-3H3.
What are the key properties of 3-[ethyl(nonan-5-yl)amino]propan-1-ol?
3-[ethyl(nonan-5-yl)amino]propan-1-ol has a molecular weight of 229.41 g/mol, XLogP of 3.44, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl(nonan-5-yl)amino]propan-1-ol is sourced from PubChem (CID 88539707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).