4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol

C12H19NO2 — CID 100950888

IUPAC4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol
SMILESCCN[C@H](C)Cc1ccc(O)c(OC)c1
InChIInChI=1S/C12H19NO2/c1-4-13-9(2)7-10-5-6-11(14)12(8-10)15-3/h5-6,8-9,13-14H,4,7H2,1-3H3/t9-/m1/s1
InChIKeyRSGBHYQZUCUCGM-SECBINFHSA-N
MW209.29 g/mol
LogP1.94
Rot. Bonds5

About 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol

4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol (PubChem CID 100950888) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol
PubChem CID100950888
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol
SMILESCCN[C@H](C)Cc1ccc(O)c(OC)c1
InChIInChI=1S/C12H19NO2/c1-4-13-9(2)7-10-5-6-11(14)12(8-10)15-3/h5-6,8-9,13-14H,4,7H2,1-3H3/t9-/m1/s1
InChIKeyRSGBHYQZUCUCGM-SECBINFHSA-N
XLogP1.94
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(hydroxyamino)propyl]-2-methoxyphenol
CID 45091599
4-(2-iodopropyl)-2-methoxyphenol
CID 89111818
2-(4-hydroxy-3-methoxyphenyl)ethane-1,1-diol
CID 146954758
1-(4-hydroxy-3-methoxyphenyl)butane-2,3-diol
CID 71398900
4-[(2R,3S)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-2-methoxyphenol
CID 11725068
N-ethyl-1-(3-methoxy-4-nitrophenyl)propan-2-amine
CID 63676496
4-(2-hydroxy-4-methylpentyl)-2-methoxyphenol
CID 139528685
1-(3,4-dimethoxyphenyl)-N-propylpropan-2-amine
CID 43200450
ethane;2-methoxy-4-propylphenol
CID 144852330
1-[1-(3,4-dimethoxyphenyl)propan-2-ylamino]propan-2-ol
CID 43499278
methyl (3R)-4-(4-hydroxy-3-methoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]-3-methylbutanoate
CID 143847693
2-[(4-hydroxy-3-methoxyphenyl)methyl]butanoic acid
CID 21120243

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol?
The IUPAC name of 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol (CID 100950888) is 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol.
What is the SMILES notation for 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol?
The canonical SMILES for 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol is CCN[C@H](C)Cc1ccc(O)c(OC)c1.
What is the InChIKey of 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol?
The InChIKey is RSGBHYQZUCUCGM-SECBINFHSA-N. The full InChI is InChI=1S/C12H19NO2/c1-4-13-9(2)7-10-5-6-11(14)12(8-10)15-3/h5-6,8-9,13-14H,4,7H2,1-3H3/t9-/m1/s1.
What are the key properties of 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol?
4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol has a molecular weight of 209.29 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-2-(ethylamino)propyl]-2-methoxyphenol is sourced from PubChem (CID 100950888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).