2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol

C17H29NO3 — CID 107669196

IUPAC2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol
SMILESCCNC(C)(CO)CC(C)Oc1ccc(CC)cc1OC
InChIInChI=1S/C17H29NO3/c1-6-14-8-9-15(16(10-14)20-5)21-13(3)11-17(4,12-19)18-7-2/h8-10,13,18-19H,6-7,11-12H2,1-5H3
InChIKeyNBFZYXRVBLZBRU-UHFFFAOYSA-N
MW295.42 g/mol
LogP2.78
Rot. Bonds9

About 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol

2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol (PubChem CID 107669196) has the molecular formula C17H29NO3 and a molecular weight of 295.42 g/mol. Its IUPAC name is 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol
PubChem CID107669196
Molecular FormulaC17H29NO3
Molecular Weight295.42 g/mol
Exact Mass295.21
IUPAC Name2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol
SMILESCCNC(C)(CO)CC(C)Oc1ccc(CC)cc1OC
InChIInChI=1S/C17H29NO3/c1-6-14-8-9-15(16(10-14)20-5)21-13(3)11-17(4,12-19)18-7-2/h8-10,13,18-19H,6-7,11-12H2,1-5H3
InChIKeyNBFZYXRVBLZBRU-UHFFFAOYSA-N
XLogP2.78
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.42
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-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

2-(ethylamino)-2-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pentan-1-ol
CID 64811206
4-(2-butan-2-ylphenoxy)-2-(ethylamino)-2-methylpentan-1-ol
CID 64804980
2-(ethylamino)-4-(4-fluorophenoxy)-2-methylpentan-1-ol
CID 64803932
N-[(3-methoxy-4-pentan-2-yloxyphenyl)methyl]-2-methylpropan-2-amine
CID 107890983
2-(cyclopropylamino)-4-(4-ethylphenoxy)-2-methylpentan-1-ol
CID 64802459
(2S)-2-(4-ethyl-2-methoxyphenoxy)propanoic acid
CID 107663541
2-(4-ethyl-2-methoxyphenoxy)pentan-3-ol
CID 107667812
3,3-dimethylbutan-1-ol;ethane;4-ethyl-1,2-dimethoxybenzene
CID 143005011
[4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol
CID 107742816
4-(3,4-dimethoxyphenyl)-3-(ethylamino)-3-methylbutanoic acid
CID 65233704
2-(ethylamino)-3-(2-methoxyphenyl)-2-methylpropan-1-ol
CID 61056299
(3-butan-2-yloxy-4-methoxyphenyl)methanol
CID 43209251

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol?
The IUPAC name of 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol (CID 107669196) is 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol.
What is the SMILES notation for 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol?
The canonical SMILES for 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol is CCNC(C)(CO)CC(C)Oc1ccc(CC)cc1OC.
What is the InChIKey of 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol?
The InChIKey is NBFZYXRVBLZBRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO3/c1-6-14-8-9-15(16(10-14)20-5)21-13(3)11-17(4,12-19)18-7-2/h8-10,13,18-19H,6-7,11-12H2,1-5H3.
What are the key properties of 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol?
2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol has a molecular weight of 295.42 g/mol, XLogP of 2.78, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-(4-ethyl-2-methoxyphenoxy)-2-methylpentan-1-ol is sourced from PubChem (CID 107669196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).