2-(1-hydroxyethyl)-5-(N-methylanilino)phenol

C15H17NO2 — CID 79603574

IUPAC2-(1-hydroxyethyl)-5-(N-methylanilino)phenol
SMILESCC(O)c1ccc(N(C)c2ccccc2)cc1O
InChIInChI=1S/C15H17NO2/c1-11(17)14-9-8-13(10-15(14)18)16(2)12-6-4-3-5-7-12/h3-11,17-18H,1-2H3
InChIKeyNYQSAGVSYOXGCJ-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.21
Rot. Bonds3

About 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol

2-(1-hydroxyethyl)-5-(N-methylanilino)phenol (PubChem CID 79603574) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol.

Molecular Properties

Compound Name2-(1-hydroxyethyl)-5-(N-methylanilino)phenol
PubChem CID79603574
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-(1-hydroxyethyl)-5-(N-methylanilino)phenol
SMILESCC(O)c1ccc(N(C)c2ccccc2)cc1O
InChIInChI=1S/C15H17NO2/c1-11(17)14-9-8-13(10-15(14)18)16(2)12-6-4-3-5-7-12/h3-11,17-18H,1-2H3
InChIKeyNYQSAGVSYOXGCJ-UHFFFAOYSA-N
XLogP3.21
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol?
The IUPAC name of 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol (CID 79603574) is 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol.
What is the SMILES notation for 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol?
The canonical SMILES for 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol is CC(O)c1ccc(N(C)c2ccccc2)cc1O.
What is the InChIKey of 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol?
The InChIKey is NYQSAGVSYOXGCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-11(17)14-9-8-13(10-15(14)18)16(2)12-6-4-3-5-7-12/h3-11,17-18H,1-2H3.
What are the key properties of 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol?
2-(1-hydroxyethyl)-5-(N-methylanilino)phenol has a molecular weight of 243.31 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxyethyl)-5-(N-methylanilino)phenol is sourced from PubChem (CID 79603574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).