2-[N-methyl-4-(4-methylphenyl)anilino]ethanol

C16H19NO — CID 134375637

IUPAC2-[N-methyl-4-(4-methylphenyl)anilino]ethanol
SMILESCc1ccc(-c2ccc(N(C)CCO)cc2)cc1
InChIInChI=1S/C16H19NO/c1-13-3-5-14(6-4-13)15-7-9-16(10-8-15)17(2)11-12-18/h3-10,18H,11-12H2,1-2H3
InChIKeyYDLMKVAFEXAGRH-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.09
Rot. Bonds4

About 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol

2-[N-methyl-4-(4-methylphenyl)anilino]ethanol (PubChem CID 134375637) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol.

Molecular Properties

Compound Name2-[N-methyl-4-(4-methylphenyl)anilino]ethanol
PubChem CID134375637
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-[N-methyl-4-(4-methylphenyl)anilino]ethanol
SMILESCc1ccc(-c2ccc(N(C)CCO)cc2)cc1
InChIInChI=1S/C16H19NO/c1-13-3-5-14(6-4-13)15-7-9-16(10-8-15)17(2)11-12-18/h3-10,18H,11-12H2,1-2H3
InChIKeyYDLMKVAFEXAGRH-UHFFFAOYSA-N
XLogP3.09
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol?
The IUPAC name of 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol (CID 134375637) is 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol.
What is the SMILES notation for 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol?
The canonical SMILES for 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol is Cc1ccc(-c2ccc(N(C)CCO)cc2)cc1.
What is the InChIKey of 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol?
The InChIKey is YDLMKVAFEXAGRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-13-3-5-14(6-4-13)15-7-9-16(10-8-15)17(2)11-12-18/h3-10,18H,11-12H2,1-2H3.
What are the key properties of 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol?
2-[N-methyl-4-(4-methylphenyl)anilino]ethanol has a molecular weight of 241.33 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-methyl-4-(4-methylphenyl)anilino]ethanol is sourced from PubChem (CID 134375637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).