2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol

C12H19NO — CID 13358320

IUPAC2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol
SMILESCCN(CCO)Cc1ccccc1C
InChIInChI=1S/C12H19NO/c1-3-13(8-9-14)10-12-7-5-4-6-11(12)2/h4-7,14H,3,8-10H2,1-2H3
InChIKeyGLSKVYZKMOCUEX-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.81
Rot. Bonds5

About 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol

2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol (PubChem CID 13358320) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol
PubChem CID13358320
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol
SMILESCCN(CCO)Cc1ccccc1C
InChIInChI=1S/C12H19NO/c1-3-13(8-9-14)10-12-7-5-4-6-11(12)2/h4-7,14H,3,8-10H2,1-2H3
InChIKeyGLSKVYZKMOCUEX-UHFFFAOYSA-N
XLogP1.81
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol?
The IUPAC name of 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol (CID 13358320) is 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol.
What is the SMILES notation for 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol?
The canonical SMILES for 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol is CCN(CCO)Cc1ccccc1C.
What is the InChIKey of 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol?
The InChIKey is GLSKVYZKMOCUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-3-13(8-9-14)10-12-7-5-4-6-11(12)2/h4-7,14H,3,8-10H2,1-2H3.
What are the key properties of 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol?
2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol has a molecular weight of 193.29 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[(2-methylphenyl)methyl]amino]ethanol is sourced from PubChem (CID 13358320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).