2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol

C18H27NO2 — CID 115420032

IUPAC2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCCN(CC1CCCO1)C1CC(C)c2ccccc2C1O
InChIInChI=1S/C18H27NO2/c1-3-19(12-14-7-6-10-21-14)17-11-13(2)15-8-4-5-9-16(15)18(17)20/h4-5,8-9,13-14,17-18,20H,3,6-7,10-12H2,1-2H3
InChIKeyKSQUUFLFOYGHIG-UHFFFAOYSA-N
MW289.42 g/mol
LogP3.10
Rot. Bonds4

About 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol

2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 115420032) has the molecular formula C18H27NO2 and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID115420032
Molecular FormulaC18H27NO2
Molecular Weight289.42 g/mol
Exact Mass289.20
IUPAC Name2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCCN(CC1CCCO1)C1CC(C)c2ccccc2C1O
InChIInChI=1S/C18H27NO2/c1-3-19(12-14-7-6-10-21-14)17-11-13(2)15-8-4-5-9-16(15)18(17)20/h4-5,8-9,13-14,17-18,20H,3,6-7,10-12H2,1-2H3
InChIKeyKSQUUFLFOYGHIG-UHFFFAOYSA-N
XLogP3.10
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-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-N,4-dimethyl-2-N-(oxolan-2-ylmethyl)-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 115418947
2-[cyclopropyl(propyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115419999
1-N-ethyl-1-N-(oxolan-2-ylmethyl)cyclobutane-1,3-diamine
CID 80561605
2-[ethyl(oxolan-2-ylmethyl)sulfamoyl]benzoic acid
CID 61434279
N-ethyl-2-nitro-N-(oxolan-2-ylmethyl)benzamide
CID 3350667
3-N-methyl-3-N-(oxolan-2-ylmethyl)-3,4-dihydro-2H-chromene-3,4-diamine
CID 61431445
2-[[ethyl(oxolan-2-ylmethyl)amino]methyl]-4-methylcyclohexan-1-ol
CID 62609399
1-ethyl-1-(oxolan-2-ylmethyl)-3-phenylthiourea
CID 3350664
2-(aminomethyl)-5-tert-butyl-N-ethyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 61433986
N'-ethyl-N'-(oxolan-2-ylmethyl)-2-phenylpropane-1,3-diamine
CID 61433987
N-ethyl-N-(oxolan-2-ylmethyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 80999221
6-methoxy-2-[methyl(oxolan-2-ylmethyl)amino]-2,3-dihydro-1H-inden-1-ol
CID 79374372

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol (CID 115420032) is 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol is CCN(CC1CCCO1)C1CC(C)c2ccccc2C1O.
What is the InChIKey of 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is KSQUUFLFOYGHIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO2/c1-3-19(12-14-7-6-10-21-14)17-11-13(2)15-8-4-5-9-16(15)18(17)20/h4-5,8-9,13-14,17-18,20H,3,6-7,10-12H2,1-2H3.
What are the key properties of 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 289.42 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 115420032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).