2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol

C15H23NO3 — CID 61050166

IUPAC2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol
SMILESCOc1cccc(C(C)(CO)NCC2CCCO2)c1
InChIInChI=1S/C15H23NO3/c1-15(11-17,16-10-14-7-4-8-19-14)12-5-3-6-13(9-12)18-2/h3,5-6,9,14,16-17H,4,7-8,10-11H2,1-2H3
InChIKeyFWKMUTQFWNSCTE-UHFFFAOYSA-N
MW265.35 g/mol
LogP1.67
Rot. Bonds6

About 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol

2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol (PubChem CID 61050166) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol
PubChem CID61050166
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol
SMILESCOc1cccc(C(C)(CO)NCC2CCCO2)c1
InChIInChI=1S/C15H23NO3/c1-15(11-17,16-10-14-7-4-8-19-14)12-5-3-6-13(9-12)18-2/h3,5-6,9,14,16-17H,4,7-8,10-11H2,1-2H3
InChIKeyFWKMUTQFWNSCTE-UHFFFAOYSA-N
XLogP1.67
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-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-(4-tert-butylphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol
CID 61050759
2-(3-tert-butylphenoxy)-N-[[(2S)-oxolan-2-yl]methyl]ethanamine
CID 7394073
3-methoxy-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 669434
2-[(3-tert-butylphenoxy)methyl]oxolane
CID 59734486
methyl 2-(3-hydroxyphenyl)-2-(oxolan-2-ylmethylamino)propanoate
CID 60993337
2-(3-methoxyphenoxy)-N-(oxolan-2-ylmethyl)propanamide
CID 19203851
1-cyclopropyl-2-[(3-methoxyphenyl)methyl]-3-(oxolan-2-ylmethyl)guanidine
CID 75364828
bis(3-methoxyphenyl)-(oxolan-2-yl)methanol
CID 102218683
2-[(3-methoxyphenyl)methyl]oxolane
CID 10607780
2-(3-fluorophenyl)-2-(oxolan-2-ylmethylamino)butan-1-ol
CID 114872852
1-[(3-methoxyphenyl)methyl]-3-(oxolan-2-ylmethyl)urea
CID 47133588
1-(3-methoxyphenyl)-N-(oxolan-2-ylmethyl)ethane-1,2-diamine
CID 65378177

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol?
The IUPAC name of 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol (CID 61050166) is 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol.
What is the SMILES notation for 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol?
The canonical SMILES for 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol is COc1cccc(C(C)(CO)NCC2CCCO2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol?
The InChIKey is FWKMUTQFWNSCTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-15(11-17,16-10-14-7-4-8-19-14)12-5-3-6-13(9-12)18-2/h3,5-6,9,14,16-17H,4,7-8,10-11H2,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol?
2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol has a molecular weight of 265.35 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-2-(oxolan-2-ylmethylamino)propan-1-ol is sourced from PubChem (CID 61050166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).