2-(methylamino)-1-(4-propylphenyl)ethanol

C12H19NO — CID 64988870

IUPAC2-(methylamino)-1-(4-propylphenyl)ethanol
SMILESCCCc1ccc(C(O)CNC)cc1
InChIInChI=1S/C12H19NO/c1-3-4-10-5-7-11(8-6-10)12(14)9-13-2/h5-8,12-14H,3-4,9H2,1-2H3
InChIKeyZUKSPLKGRVBXAG-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.89
Rot. Bonds5

About 2-(methylamino)-1-(4-propylphenyl)ethanol

2-(methylamino)-1-(4-propylphenyl)ethanol (PubChem CID 64988870) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(methylamino)-1-(4-propylphenyl)ethanol.

Molecular Properties

Compound Name2-(methylamino)-1-(4-propylphenyl)ethanol
PubChem CID64988870
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-(methylamino)-1-(4-propylphenyl)ethanol
SMILESCCCc1ccc(C(O)CNC)cc1
InChIInChI=1S/C12H19NO/c1-3-4-10-5-7-11(8-6-10)12(14)9-13-2/h5-8,12-14H,3-4,9H2,1-2H3
InChIKeyZUKSPLKGRVBXAG-UHFFFAOYSA-N
XLogP1.89
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(methylamino)-1-(4-propylphenyl)propane-1,2-diol
CID 171857789
3-(methylamino)-1-(4-propylphenyl)propan-1-ol
CID 112509803
4-(2-aminoethyl)phenol;4-[1-hydroxy-2-(methylamino)ethyl]phenol
CID 67313836
2-[(4-fluorophenyl)methylamino]-1-(4-propylphenyl)ethanol
CID 82316019
(1S)-1-(4-bromophenyl)-2-(methylamino)ethanol
CID 39247728
2-(methylamino)-1-(4-propoxyphenyl)ethanol
CID 62772547
3-methyl-1-(4-propylphenyl)pentan-1-ol
CID 114875906
2-[1-(4-propylphenyl)ethylamino]-1-thiophen-3-ylethanol
CID 103785297
(2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol
CID 103906705
4,4-dimethyl-1-(4-propylphenyl)pentan-1-ol
CID 114211492
4-[1-hydroxy-2-(methylamino)ethyl]benzonitrile
CID 60904428
2-(methylamino)-1-[4-(trifluoromethyl)phenyl]ethanol
CID 60903965

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-1-(4-propylphenyl)ethanol?
The IUPAC name of 2-(methylamino)-1-(4-propylphenyl)ethanol (CID 64988870) is 2-(methylamino)-1-(4-propylphenyl)ethanol.
What is the SMILES notation for 2-(methylamino)-1-(4-propylphenyl)ethanol?
The canonical SMILES for 2-(methylamino)-1-(4-propylphenyl)ethanol is CCCc1ccc(C(O)CNC)cc1.
What is the InChIKey of 2-(methylamino)-1-(4-propylphenyl)ethanol?
The InChIKey is ZUKSPLKGRVBXAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-3-4-10-5-7-11(8-6-10)12(14)9-13-2/h5-8,12-14H,3-4,9H2,1-2H3.
What are the key properties of 2-(methylamino)-1-(4-propylphenyl)ethanol?
2-(methylamino)-1-(4-propylphenyl)ethanol has a molecular weight of 193.29 g/mol, XLogP of 1.89, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-1-(4-propylphenyl)ethanol is sourced from PubChem (CID 64988870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).