2-(ethylamino)tetradecan-4-ol

C16H35NO — CID 174619810

IUPAC2-(ethylamino)tetradecan-4-ol
SMILESCCCCCCCCCCC(O)CC(C)NCC
InChIInChI=1S/C16H35NO/c1-4-6-7-8-9-10-11-12-13-16(18)14-15(3)17-5-2/h15-18H,4-14H2,1-3H3
InChIKeyYLUIPDWUXIMEMA-UHFFFAOYSA-N
MW257.46 g/mol
LogP4.27
Rot. Bonds13

About 2-(ethylamino)tetradecan-4-ol

2-(ethylamino)tetradecan-4-ol (PubChem CID 174619810) has the molecular formula C16H35NO and a molecular weight of 257.46 g/mol. Its IUPAC name is 2-(ethylamino)tetradecan-4-ol.

Molecular Properties

Compound Name2-(ethylamino)tetradecan-4-ol
PubChem CID174619810
Molecular FormulaC16H35NO
Molecular Weight257.46 g/mol
Exact Mass257.27
IUPAC Name2-(ethylamino)tetradecan-4-ol
SMILESCCCCCCCCCCC(O)CC(C)NCC
InChIInChI=1S/C16H35NO/c1-4-6-7-8-9-10-11-12-13-16(18)14-15(3)17-5-2/h15-18H,4-14H2,1-3H3
InChIKeyYLUIPDWUXIMEMA-UHFFFAOYSA-N
XLogP4.27
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.46
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(ethylamino)tetradecan-4-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

hentriacontane-14,16-diol
CID 87514654
triacontane-6,8-diol
CID 85096450
(7S,9R)-tetratriacontane-7,9-diol
CID 165357894
(6S,8S)-heptacosane-6,8-diol
CID 10693038
(2R,4R)-decane-2,4-diol
CID 16752205
(4S)-2-methylnonan-4-ol
CID 86308805
5-(ethylamino)hexan-3-ol
CID 140740980
(5S,7R)-dodecane-5,7-diol
CID 12060471
3-methyltridecan-5-ol
CID 13025106
(3S,5S)-2-methylundecane-3,5-diol
CID 14784007
(7R)-hexatriacontan-7-ol
CID 88529159
nonacosane-7,20-diol
CID 174949468

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)tetradecan-4-ol?
The IUPAC name of 2-(ethylamino)tetradecan-4-ol (CID 174619810) is 2-(ethylamino)tetradecan-4-ol.
What is the SMILES notation for 2-(ethylamino)tetradecan-4-ol?
The canonical SMILES for 2-(ethylamino)tetradecan-4-ol is CCCCCCCCCCC(O)CC(C)NCC.
What is the InChIKey of 2-(ethylamino)tetradecan-4-ol?
The InChIKey is YLUIPDWUXIMEMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO/c1-4-6-7-8-9-10-11-12-13-16(18)14-15(3)17-5-2/h15-18H,4-14H2,1-3H3.
What are the key properties of 2-(ethylamino)tetradecan-4-ol?
2-(ethylamino)tetradecan-4-ol has a molecular weight of 257.46 g/mol, XLogP of 4.27, 13 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)tetradecan-4-ol is sourced from PubChem (CID 174619810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).