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Menetryl

C12H19NO — CID 10734

💊View drug profile → etafedrine

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC2-[ethyl(methyl)amino]-1-phenylpropan-1-ol
SMILESCCN(C)C(C)C(O)c1ccccc1
InChIInChI=1S/C12H19NO/c1-4-13(3)10(2)12(14)11-8-6-5-7-9-11/h5-10,12,14H,4H2,1-3H3
InChIKeyIRVLBORJKFZWMI-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.06
Rot. Bonds4

About Menetryl

Menetryl (PubChem CID 10734) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-[ethyl(methyl)amino]-1-phenylpropan-1-ol.

Molecular Properties

Compound NameMenetryl
PubChem CID10734
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-[ethyl(methyl)amino]-1-phenylpropan-1-ol
SMILESCCN(C)C(C)C(O)c1ccccc1
InChIInChI=1S/C12H19NO/c1-4-13(3)10(2)12(14)11-8-6-5-7-9-11/h5-10,12,14H,4H2,1-3H3
InChIKeyIRVLBORJKFZWMI-UHFFFAOYSA-N
XLogP2.06
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-2-[2-[[(1S)-1-hydroxy-1-phenylpropan-2-yl]-methylamino]ethyl-methylamino]-1-phenylpropan-1-ol
CID 102595877
1-[(1-hydroxy-1-phenylpropan-2-yl)-methylamino]propan-2-one
CID 85280198
(2R)-2-(dimethylamino)-1-phenylpropan-1-ol;hydrochloride
CID 163285620
(1S,2R)-2-(dimethylamino)-1-phenylpropan-1-ol;hydrochloride
CID 3041454
(1R,2S)-2-[[(2R)-2-amino-3-methylbutyl]-methylamino]-1-phenylpropan-1-ol
CID 86342127
(1R,2S)-2-[2,2-dimethoxyethyl(methyl)amino]-1-phenylpropan-1-ol
CID 102421960
(1S,2R)-2-(dipropylamino)-1-phenylpropan-1-ol
CID 11118019
N-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-N-methylpropanamide
CID 11138684
2-[methyl-[(2-propan-2-yloxyphenyl)methyl]amino]-1-phenylpropan-1-ol
CID 54856739
2-[(4-chlorophenyl)methyl-methylamino]-1-phenylpropan-1-ol
CID 54856639
2-[2-hydroxyethyl(methyl)amino]-1,2-diphenylethanol
CID 14391199
2-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-methylamino]acetohydrazide
CID 26416444

Frequently Asked Questions

What is the IUPAC name of Menetryl?
The IUPAC name of Menetryl (CID 10734) is 2-[ethyl(methyl)amino]-1-phenylpropan-1-ol.
What is the SMILES notation for Menetryl?
The canonical SMILES for Menetryl is CCN(C)C(C)C(O)c1ccccc1.
What is the InChIKey of Menetryl?
The InChIKey is IRVLBORJKFZWMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-4-13(3)10(2)12(14)11-8-6-5-7-9-11/h5-10,12,14H,4H2,1-3H3.
What are the key properties of Menetryl?
Menetryl has a molecular weight of 193.29 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Menetryl is sourced from PubChem (CID 10734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

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