2-(ethylamino)-2-(4-methylphenyl)propan-1-ol

C12H19NO — CID 61048119

IUPAC2-(ethylamino)-2-(4-methylphenyl)propan-1-ol
SMILESCCNC(C)(CO)c1ccc(C)cc1
InChIInChI=1S/C12H19NO/c1-4-13-12(3,9-14)11-7-5-10(2)6-8-11/h5-8,13-14H,4,9H2,1-3H3
InChIKeyPJLFAHRUNGWKOT-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.81
Rot. Bonds4

About 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol

2-(ethylamino)-2-(4-methylphenyl)propan-1-ol (PubChem CID 61048119) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-2-(4-methylphenyl)propan-1-ol
PubChem CID61048119
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-(ethylamino)-2-(4-methylphenyl)propan-1-ol
SMILESCCNC(C)(CO)c1ccc(C)cc1
InChIInChI=1S/C12H19NO/c1-4-13-12(3,9-14)11-7-5-10(2)6-8-11/h5-8,13-14H,4,9H2,1-3H3
InChIKeyPJLFAHRUNGWKOT-UHFFFAOYSA-N
XLogP1.81
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-((1-Phenylethyl)amino)ethan-1-ol
CID 14909
Mk-1496
CID 67313626
Fepradinol
CID 68819
2-(tert-Butylamino)-1-phenylethanol
CID 533905
H 29-50
CID 192962
1,3-Propanediol, 2-(((1,1'-biphenyl)-4-ylmethyl)amino)-2-methyl-, hydrochloride
CID 149654
2-Amino-2-phenylethanol
CID 92466
2-(Benzylamino)propan-1-ol
CID 138873
(R)-2-(benzylamino)butan-1-ol
CID 927306
(R)-beta-aminophenethyl alcohol
CID 2724025
(2RS)-2-(Dimethylamino)-2-phenylbutanol
CID 3016037
2-[(4-Ethylphenyl)methylamino]-1-phenylethanol;hydrochloride
CID 6459920

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol?
The IUPAC name of 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol (CID 61048119) is 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol.
What is the SMILES notation for 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol?
The canonical SMILES for 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol is CCNC(C)(CO)c1ccc(C)cc1.
What is the InChIKey of 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol?
The InChIKey is PJLFAHRUNGWKOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-4-13-12(3,9-14)11-7-5-10(2)6-8-11/h5-8,13-14H,4,9H2,1-3H3.
What are the key properties of 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol?
2-(ethylamino)-2-(4-methylphenyl)propan-1-ol has a molecular weight of 193.29 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-(4-methylphenyl)propan-1-ol is sourced from PubChem (CID 61048119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).