[2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride

C11H18ClNO — CID 75422080

IUPAC[2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride
SMILESCN(C)CCc1ccccc1CO.Cl
InChIInChI=1S/C11H17NO.ClH/c1-12(2)8-7-10-5-3-4-6-11(10)9-13;/h3-6,13H,7-9H2,1-2H3;1H
InChIKeyPJDUZZDRKRVYAG-UHFFFAOYSA-N
MW215.72 g/mol
LogP1.70
Rot. Bonds4

About [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride

[2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride (PubChem CID 75422080) has the molecular formula C11H18ClNO and a molecular weight of 215.72 g/mol. Its IUPAC name is [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride.

Molecular Properties

Compound Name[2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride
PubChem CID75422080
Molecular FormulaC11H18ClNO
Molecular Weight215.72 g/mol
Exact Mass215.11
IUPAC Name[2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride
SMILESCN(C)CCc1ccccc1CO.Cl
InChIInChI=1S/C11H17NO.ClH/c1-12(2)8-7-10-5-3-4-6-11(10)9-13;/h3-6,13H,7-9H2,1-2H3;1H
InChIKeyPJDUZZDRKRVYAG-UHFFFAOYSA-N
XLogP1.70
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.72
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride?
The IUPAC name of [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride (CID 75422080) is [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride.
What is the SMILES notation for [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride?
The canonical SMILES for [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride is CN(C)CCc1ccccc1CO.Cl.
What is the InChIKey of [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride?
The InChIKey is PJDUZZDRKRVYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO.ClH/c1-12(2)8-7-10-5-3-4-6-11(10)9-13;/h3-6,13H,7-9H2,1-2H3;1H.
What are the key properties of [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride?
[2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride has a molecular weight of 215.72 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(dimethylamino)ethyl]phenyl]methanol;hydrochloride is sourced from PubChem (CID 75422080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).