(2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol

C14H18N2O3 — CID 66515955

IUPAC(2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol
SMILESCc1noc(C)c1COc1ccc([C@H](N)CO)cc1
InChIInChI=1S/C14H18N2O3/c1-9-13(10(2)19-16-9)8-18-12-5-3-11(4-6-12)14(15)7-17/h3-6,14,17H,7-8,15H2,1-2H3/t14-/m1/s1
InChIKeyUDTAEGLNBSRTBU-CQSZACIVSA-N
MW262.31 g/mol
LogP1.86
Rot. Bonds5

About (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol

(2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol (PubChem CID 66515955) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol
PubChem CID66515955
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name(2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol
SMILESCc1noc(C)c1COc1ccc([C@H](N)CO)cc1
InChIInChI=1S/C14H18N2O3/c1-9-13(10(2)19-16-9)8-18-12-5-3-11(4-6-12)14(15)7-17/h3-6,14,17H,7-8,15H2,1-2H3/t14-/m1/s1
InChIKeyUDTAEGLNBSRTBU-CQSZACIVSA-N
XLogP1.86
TPSA81.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol 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-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine
CID 60888210
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-[1-(4-methylphenyl)propyl]acetamide
CID 112766082
N-[[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine
CID 60657484
[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-phenylmethanone
CID 18074313
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-methoxyacetamide
CID 30796971
7-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]naphthalen-2-ol
CID 43326466
(Z)-3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]prop-2-enoic acid
CID 97305645
[1-[[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]methylamino]cyclopentyl]methanol
CID 111916814
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[2-(methylamino)-2-oxoethoxy]benzamide
CID 110495682
(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-phenylphenoxy)acetate
CID 2364688
(2-amino-2-oxoethyl) 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetate
CID 7771114
N-(1-amino-3-methyl-1-oxopentan-2-yl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
CID 78773318

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol?
The IUPAC name of (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol (CID 66515955) is (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol.
What is the SMILES notation for (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol?
The canonical SMILES for (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol is Cc1noc(C)c1COc1ccc([C@H](N)CO)cc1.
What is the InChIKey of (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol?
The InChIKey is UDTAEGLNBSRTBU-CQSZACIVSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-9-13(10(2)19-16-9)8-18-12-5-3-11(4-6-12)14(15)7-17/h3-6,14,17H,7-8,15H2,1-2H3/t14-/m1/s1.
What are the key properties of (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol?
(2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol has a molecular weight of 262.31 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol is sourced from PubChem (CID 66515955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).