2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine

C14H21NO2 — CID 115840738

IUPAC2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine
SMILESCOc1cccc(CC(N)C2CCC(C)O2)c1
InChIInChI=1S/C14H21NO2/c1-10-6-7-14(17-10)13(15)9-11-4-3-5-12(8-11)16-2/h3-5,8,10,13-14H,6-7,9,15H2,1-2H3
InChIKeyHGADEVCABYOOAG-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.13
Rot. Bonds4

About 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine

2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine (PubChem CID 115840738) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine
PubChem CID115840738
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine
SMILESCOc1cccc(CC(N)C2CCC(C)O2)c1
InChIInChI=1S/C14H21NO2/c1-10-6-7-14(17-10)13(15)9-11-4-3-5-12(8-11)16-2/h3-5,8,10,13-14H,6-7,9,15H2,1-2H3
InChIKeyHGADEVCABYOOAG-UHFFFAOYSA-N
XLogP2.13
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine 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

1-(1,4-dioxan-2-yl)-2-(3-methoxyphenyl)ethanamine
CID 65352870
1-(4,4-dimethylcyclohexyl)-2-(3-methoxyphenyl)ethanamine
CID 65391804
(2S)-2-amino-3-(3-methoxyphenyl)propan-1-ol
CID 28804581
(1S)-1,2-bis(3-methoxyphenyl)ethanamine
CID 40618709
N-ethyl-2-[(3-methoxyphenyl)methyl]-3-(5-methyloxolan-2-yl)propan-1-amine
CID 103138315
1-chloro-2-(3-methoxyphenyl)ethanamine
CID 67681258
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(3-methoxyphenyl)ethanamine
CID 64984484
1,2-bis(3-methoxyphenyl)ethanamine;hydrochloride
CID 54599738
4-(3-methoxyphenyl)-3-methylbutan-2-amine
CID 60995099
1-(1-methoxy-4-methylcyclohexyl)-2-(3-methoxyphenyl)ethanamine
CID 116766322
1-(5-methyloxolan-2-yl)-4-phenylbutan-1-amine
CID 115849389
2-(3-methoxyanilino)-2-(5-methyloxolan-2-yl)acetonitrile
CID 82838217

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine?
The IUPAC name of 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine (CID 115840738) is 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine.
What is the SMILES notation for 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine?
The canonical SMILES for 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine is COc1cccc(CC(N)C2CCC(C)O2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine?
The InChIKey is HGADEVCABYOOAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10-6-7-14(17-10)13(15)9-11-4-3-5-12(8-11)16-2/h3-5,8,10,13-14H,6-7,9,15H2,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine?
2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine has a molecular weight of 235.33 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-1-(5-methyloxolan-2-yl)ethanamine is sourced from PubChem (CID 115840738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).