3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol

C15H23NO2 — CID 65185382

IUPAC3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol
SMILESCOc1ccc(C)cc1C(CN)C(O)C1CC1C
InChIInChI=1S/C15H23NO2/c1-9-4-5-14(18-3)12(6-9)13(8-16)15(17)11-7-10(11)2/h4-6,10-11,13,15,17H,7-8,16H2,1-3H3
InChIKeyMZVOAWUKQDRAIP-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.06
Rot. Bonds5

About 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol

3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol (PubChem CID 65185382) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol.

Molecular Properties

Compound Name3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol
PubChem CID65185382
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol
SMILESCOc1ccc(C)cc1C(CN)C(O)C1CC1C
InChIInChI=1S/C15H23NO2/c1-9-4-5-14(18-3)12(6-9)13(8-16)15(17)11-7-10(11)2/h4-6,10-11,13,15,17H,7-8,16H2,1-3H3
InChIKeyMZVOAWUKQDRAIP-UHFFFAOYSA-N
XLogP2.06
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)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

3-amino-1-cyclopropyl-2-(2-methoxy-5-methylphenyl)propan-1-ol
CID 65185180
3-amino-2-(2-methoxy-5-methylphenyl)-1-(oxan-4-yl)propan-1-ol
CID 65185434
3-amino-1-(4-bromophenyl)-2-(2-methoxy-5-methylphenyl)propan-1-ol
CID 65185329
3-amino-1-(5-ethylthiophen-2-yl)-2-(2-methoxy-5-methylphenyl)propan-1-ol
CID 65185380
1-(2-methoxy-5-methylphenyl)-2-[(3-methylcyclopentyl)amino]ethanol
CID 114545638
2-(3,5-dimethylcyclohexyl)oxy-1-(2-methoxy-5-methylphenyl)ethanol
CID 64728823
2-(3,5-dimethylpiperidin-1-yl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 60980968
1-(2-methoxy-5-methylphenyl)-2-methylpropane-1,3-diamine
CID 116933048
1-(2-methoxy-5-methylphenyl)-N,N-dimethylethane-1,2-diamine
CID 82283769
(2S)-2-amino-2-(2-methoxy-5-methylphenyl)ethanol
CID 55278412
ethyl 2-hydroxy-2-(2-methoxy-5-methylphenyl)acetate
CID 10775496
3-amino-1-(2-methoxy-5-methylphenyl)butan-1-ol
CID 81462431

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol?
The IUPAC name of 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol (CID 65185382) is 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol.
What is the SMILES notation for 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol?
The canonical SMILES for 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol is COc1ccc(C)cc1C(CN)C(O)C1CC1C.
What is the InChIKey of 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol?
The InChIKey is MZVOAWUKQDRAIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-9-4-5-14(18-3)12(6-9)13(8-16)15(17)11-7-10(11)2/h4-6,10-11,13,15,17H,7-8,16H2,1-3H3.
What are the key properties of 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol?
3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol has a molecular weight of 249.35 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(2-methoxy-5-methylphenyl)-1-(2-methylcyclopropyl)propan-1-ol is sourced from PubChem (CID 65185382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).