5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride

C9H14ClNO2 — CID 172550087

IUPAC5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride
SMILESCc1ccc(NCCO)cc1O.Cl
InChIInChI=1S/C9H13NO2.ClH/c1-7-2-3-8(6-9(7)12)10-4-5-11;/h2-3,6,10-12H,4-5H2,1H3;1H
InChIKeySRFMHYOOXCZPKZ-UHFFFAOYSA-N
MW203.67 g/mol
LogP1.53
Rot. Bonds3

About 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride

5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride (PubChem CID 172550087) has the molecular formula C9H14ClNO2 and a molecular weight of 203.67 g/mol. Its IUPAC name is 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride.

Molecular Properties

Compound Name5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride
PubChem CID172550087
Molecular FormulaC9H14ClNO2
Molecular Weight203.67 g/mol
Exact Mass203.07
IUPAC Name5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride
SMILESCc1ccc(NCCO)cc1O.Cl
InChIInChI=1S/C9H13NO2.ClH/c1-7-2-3-8(6-9(7)12)10-4-5-11;/h2-3,6,10-12H,4-5H2,1H3;1H
InChIKeySRFMHYOOXCZPKZ-UHFFFAOYSA-N
XLogP1.53
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.67
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-(2-hydroxyethyl)-6-methylphenol;5-(2-hydroxyethylamino)-2-methylphenol
CID 161456445
N-[2-(3-hydroxy-4-methylanilino)ethyl]methanesulfonamide
CID 22406160
ethane;2-(4-methoxy-3-methylanilino)ethanol
CID 142353980
5-[(3-hydroxyphenyl)methylamino]-2-methylphenol
CID 22983329
2,6-dibromo-4-[(3-hydroxy-4-methylanilino)methyl]phenol
CID 107741199
5-(cycloheptylmethylamino)-2-methylphenol
CID 107699720
5-[[1-(2-hydroxyethyl)triazol-4-yl]methylamino]-2-methylphenol
CID 107701075
2-[2-(4-amino-3-methylanilino)ethylamino]ethanol
CID 23104585
4-[(3-hydroxy-4-methylanilino)methyl]-2,6-dimethoxyphenol
CID 107700768
5-[(3-chlorophenyl)methylamino]-2-methylphenol
CID 18615765
4-(3-hydroxy-4-methylanilino)-2,2-dimethyl-4-oxobutanoic acid
CID 107699577
2-(3-hydroxy-4-methylanilino)-N-(2-hydroxyphenyl)acetamide
CID 150167454

Frequently Asked Questions

What is the IUPAC name of 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride?
The IUPAC name of 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride (CID 172550087) is 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride.
What is the SMILES notation for 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride?
The canonical SMILES for 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride is Cc1ccc(NCCO)cc1O.Cl.
What is the InChIKey of 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride?
The InChIKey is SRFMHYOOXCZPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2.ClH/c1-7-2-3-8(6-9(7)12)10-4-5-11;/h2-3,6,10-12H,4-5H2,1H3;1H.
What are the key properties of 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride?
5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride has a molecular weight of 203.67 g/mol, XLogP of 1.53, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-hydroxyethylamino)-2-methylphenol;hydrochloride is sourced from PubChem (CID 172550087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).