(4-ethoxyphenyl)-(methylamino)methanol

C10H15NO2 — CID 116954646

IUPAC(4-ethoxyphenyl)-(methylamino)methanol
SMILESCCOc1ccc(C(O)NC)cc1
InChIInChI=1S/C10H15NO2/c1-3-13-9-6-4-8(5-7-9)10(12)11-2/h4-7,10-12H,3H2,1-2H3
InChIKeyHJJZLBGKQYHOQT-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.30
Rot. Bonds4

About (4-ethoxyphenyl)-(methylamino)methanol

(4-ethoxyphenyl)-(methylamino)methanol (PubChem CID 116954646) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is (4-ethoxyphenyl)-(methylamino)methanol.

Molecular Properties

Compound Name(4-ethoxyphenyl)-(methylamino)methanol
PubChem CID116954646
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name(4-ethoxyphenyl)-(methylamino)methanol
SMILESCCOc1ccc(C(O)NC)cc1
InChIInChI=1S/C10H15NO2/c1-3-13-9-6-4-8(5-7-9)10(12)11-2/h4-7,10-12H,3H2,1-2H3
InChIKeyHJJZLBGKQYHOQT-UHFFFAOYSA-N
XLogP1.30
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(4-ethoxyphenyl)-3-(methylamino)propan-1-ol
CID 112509819
amino-(4-ethoxyphenyl)methanol
CID 116939610
1-(4-ethoxyphenyl)-2-ethyl-N-methylbutan-1-amine
CID 43481938
1-(4-ethoxyphenyl)-2,2-difluoro-N-methylethanamine
CID 80604791
1-(4-ethoxyphenyl)-2,2-difluoroethanol
CID 80604264
3-[2-(4-ethoxyphenyl)-2-(methylamino)ethyl]sulfanylbutan-2-ol
CID 107772633
methyl 2-(4-ethoxyphenyl)-2-hydroxyacetate
CID 62214123
1-(4-ethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine
CID 79052774
1-(4-ethoxyphenyl)-N-methylpentan-1-amine
CID 43481859
2-amino-3-(4-ethoxyphenyl)-3-(methylamino)propanoic acid
CID 116957355
2-(4-ethoxyphenyl)propanedial
CID 3698706
1-(4-ethoxyphenyl)-N,5-dimethylhexan-1-amine
CID 105028805

Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl)-(methylamino)methanol?
The IUPAC name of (4-ethoxyphenyl)-(methylamino)methanol (CID 116954646) is (4-ethoxyphenyl)-(methylamino)methanol.
What is the SMILES notation for (4-ethoxyphenyl)-(methylamino)methanol?
The canonical SMILES for (4-ethoxyphenyl)-(methylamino)methanol is CCOc1ccc(C(O)NC)cc1.
What is the InChIKey of (4-ethoxyphenyl)-(methylamino)methanol?
The InChIKey is HJJZLBGKQYHOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-3-13-9-6-4-8(5-7-9)10(12)11-2/h4-7,10-12H,3H2,1-2H3.
What are the key properties of (4-ethoxyphenyl)-(methylamino)methanol?
(4-ethoxyphenyl)-(methylamino)methanol has a molecular weight of 181.23 g/mol, XLogP of 1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl)-(methylamino)methanol is sourced from PubChem (CID 116954646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).