Ephedrine Hydrochloride

C10H16ClNO — CID 65326

IUPAC(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;hydrochloride
SMILESC[C@@H]([C@@H](C1=CC=CC=C1)O)NC.Cl
InChIInChI=1S/C10H15NO.ClH/c1-8(11-2)10(12)9-6-4-3-5-7-9;/h3-8,10-12H,1-2H3;1H/t8-,10-;/m0./s1
InChIKeyBALXUFOVQVENIU-GNAZCLTHSA-N
MW201.69 g/mol
LogP—
Rot. Bonds3

About Ephedrine Hydrochloride

Ephedrine Hydrochloride (PubChem CID 65326) has the molecular formula C10H16ClNO and a molecular weight of 201.69 g/mol. Its IUPAC name is (1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;hydrochloride.

Molecular Properties

Compound NameEphedrine Hydrochloride
PubChem CID65326
Molecular FormulaC10H16ClNO
Molecular Weight201.69 g/mol
Exact Mass201.09
IUPAC Name(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;hydrochloride
SMILESC[C@@H]([C@@H](C1=CC=CC=C1)O)NC.Cl
InChIInChI=1S/C10H15NO.ClH/c1-8(11-2)10(12)9-6-4-3-5-7-9;/h3-8,10-12H,1-2H3;1H/t8-,10-;/m0./s1
InChIKeyBALXUFOVQVENIU-GNAZCLTHSA-N
XLogP—
TPSA32.30 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity121

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

Pseudoephedrine
CID 7028
Ephedrine
CID 9294
Phenylpropanolamine
CID 10297
Cathine
CID 441457
(1S,2R)-(+)-Norephedrine
CID 4786
Phenmetrazine Hydrochloride
CID 92159
Pseudoephedrine Hydrochloride
CID 9581
Ephedrine Sulfate
CID 5359318
Phenylethanolamine
CID 1000
Oxilofrine
CID 688009
Phenylpropanolamine Hydrochloride
CID 62943
DL-Ephedrine
CID 5032

Frequently Asked Questions

What is the IUPAC name of Ephedrine Hydrochloride?
The IUPAC name of Ephedrine Hydrochloride (CID 65326) is (1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;hydrochloride.
What is the SMILES notation for Ephedrine Hydrochloride?
The canonical SMILES for Ephedrine Hydrochloride is C[C@@H]([C@@H](C1=CC=CC=C1)O)NC.Cl.
What is the InChIKey of Ephedrine Hydrochloride?
The InChIKey is BALXUFOVQVENIU-GNAZCLTHSA-N. The full InChI is InChI=1S/C10H15NO.ClH/c1-8(11-2)10(12)9-6-4-3-5-7-9;/h3-8,10-12H,1-2H3;1H/t8-,10-;/m0./s1.
What are the key properties of Ephedrine Hydrochloride?
Ephedrine Hydrochloride has a molecular weight of 201.69 g/mol, XLogP of not available, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Ephedrine Hydrochloride is sourced from PubChem (CID 65326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).