1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol

C12H19NO2 — CID 14569262

IUPAC1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol
SMILESCc1ccccc1N(CCO)CC(C)O
InChIInChI=1S/C12H19NO2/c1-10-5-3-4-6-12(10)13(7-8-14)9-11(2)15/h3-6,11,14-15H,7-9H2,1-2H3
InChIKeyFBMYDGXPCUKHLW-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.17
Rot. Bonds5

About 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol

1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol (PubChem CID 14569262) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol.

Molecular Properties

Compound Name1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol
PubChem CID14569262
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol
SMILESCc1ccccc1N(CCO)CC(C)O
InChIInChI=1S/C12H19NO2/c1-10-5-3-4-6-12(10)13(7-8-14)9-11(2)15/h3-6,11,14-15H,7-9H2,1-2H3
InChIKeyFBMYDGXPCUKHLW-UHFFFAOYSA-N
XLogP1.17
TPSA43.70 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 ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-ethyl-2-methylanilino)ethanol sulfate
CID 19002397
2-[2-[bis(2-hydroxyethyl)amino]-N-(2-hydroxyethyl)-3-methylanilino]ethanol
CID 6452801
2-[2-[(1R)-1-aminoethyl]-N-(2,2-difluoroethyl)anilino]ethanol
CID 107480549
(1R)-1-[2-[2,2-difluoroethyl(2-hydroxyethyl)amino]phenyl]propan-1-ol
CID 107480997
1-(3,4-dimethylphenyl)-2-(N-ethyl-2-methylanilino)ethanol
CID 63473038
1-(N-ethyl-2-methylanilino)-3-sulfanylpropan-2-ol
CID 174382488
(1S)-1-[2-[2-hydroxyethyl(propyl)amino]phenyl]ethanol
CID 63371248
1-(N-ethyl-2-methylanilino)pentan-2-ol
CID 62041707
[4-[bis(2-hydroxyethyl)amino]phenyl]-[4-[bis(2-hydroxypropyl)amino]phenyl]methanone
CID 21325578
1-(2-hydroxyethyl)-1-(2-methylphenyl)urea
CID 14685232
CID 173160114
CID 173160114
1-(N-amino-2-methylanilino)ethanol
CID 146479047

Frequently Asked Questions

What is the IUPAC name of 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol?
The IUPAC name of 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol (CID 14569262) is 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol.
What is the SMILES notation for 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol?
The canonical SMILES for 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol is Cc1ccccc1N(CCO)CC(C)O.
What is the InChIKey of 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol?
The InChIKey is FBMYDGXPCUKHLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-10-5-3-4-6-12(10)13(7-8-14)9-11(2)15/h3-6,11,14-15H,7-9H2,1-2H3.
What are the key properties of 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol?
1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol has a molecular weight of 209.29 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[N-(2-hydroxyethyl)-2-methylanilino]propan-2-ol is sourced from PubChem (CID 14569262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).