2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol

C14H22FNO2 — CID 64803932

IUPAC2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol
SMILESCCNC(C)(CO)CC(C)Oc1ccc(F)cc1
InChIInChI=1S/C14H22FNO2/c1-4-16-14(3,10-17)9-11(2)18-13-7-5-12(15)6-8-13/h5-8,11,16-17H,4,9-10H2,1-3H3
InChIKeyIZSYEYUSCYWELJ-UHFFFAOYSA-N
MW255.33 g/mol
LogP2.34
Rot. Bonds7

About 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol

2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol (PubChem CID 64803932) has the molecular formula C14H22FNO2 and a molecular weight of 255.33 g/mol. Its IUPAC name is 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol
PubChem CID64803932
Molecular FormulaC14H22FNO2
Molecular Weight255.33 g/mol
Exact Mass255.16
IUPAC Name2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol
SMILESCCNC(C)(CO)CC(C)Oc1ccc(F)cc1
InChIInChI=1S/C14H22FNO2/c1-4-16-14(3,10-17)9-11(2)18-13-7-5-12(15)6-8-13/h5-8,11,16-17H,4,9-10H2,1-3H3
InChIKeyIZSYEYUSCYWELJ-UHFFFAOYSA-N
XLogP2.34
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.33
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-butan-2-ylphenoxy)-2-(ethylamino)-2-methylpentan-1-ol
CID 64804980
4-(4-butan-2-ylphenoxy)-2-methyl-2-(methylamino)pentan-1-ol
CID 107669189
4-(4-fluorophenoxy)-2-methyl-2-(propylamino)pentanoic acid
CID 64706231
2-(cyclopropylamino)-4-(4-ethylphenoxy)-2-methylpentan-1-ol
CID 64802459
2-(ethylamino)-2-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pentan-1-ol
CID 64811206
2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol
CID 107669196
4-(2,4-difluorophenyl)sulfanyl-2-(ethylamino)-2-methylpentan-1-ol
CID 64820392
N-ethyl-2-(4-fluorophenoxy)propan-1-amine
CID 62454128
4-(3-fluoro-4-methylphenoxy)-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 107171567
4-(3,5-dimethylphenoxy)-2-methyl-2-(propylamino)pentan-1-ol
CID 64804347
2-methyl-4-(3-methylphenoxy)-2-(propylamino)pentan-1-ol
CID 64802099
4-(4-fluorophenoxy)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64706234

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol?
The IUPAC name of 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol (CID 64803932) is 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol.
What is the SMILES notation for 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol?
The canonical SMILES for 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol is CCNC(C)(CO)CC(C)Oc1ccc(F)cc1.
What is the InChIKey of 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol?
The InChIKey is IZSYEYUSCYWELJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22FNO2/c1-4-16-14(3,10-17)9-11(2)18-13-7-5-12(15)6-8-13/h5-8,11,16-17H,4,9-10H2,1-3H3.
What are the key properties of 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol?
2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol has a molecular weight of 255.33 g/mol, XLogP of 2.34, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol is sourced from PubChem (CID 64803932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).