2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol

C13H19NO2 — CID 163590504

IUPAC2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol
SMILESCOc1ccccc1/C(C)=N/C(C)(C)CO
InChIInChI=1S/C13H19NO2/c1-10(14-13(2,3)9-15)11-7-5-6-8-12(11)16-4/h5-8,15H,9H2,1-4H3/b14-10+
InChIKeyGPDUNTNEFFNACT-GXDHUFHOSA-N
MW221.30 g/mol
LogP2.28
Rot. Bonds4

About 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol

2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol (PubChem CID 163590504) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol
PubChem CID163590504
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol
SMILESCOc1ccccc1/C(C)=N/C(C)(C)CO
InChIInChI=1S/C13H19NO2/c1-10(14-13(2,3)9-15)11-7-5-6-8-12(11)16-4/h5-8,15H,9H2,1-4H3/b14-10+
InChIKeyGPDUNTNEFFNACT-GXDHUFHOSA-N
XLogP2.28
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(E)-N-ethoxy-1-(2-methoxyphenyl)ethanimine
CID 89151360
1-methoxy-2-pent-2-en-2-ylbenzene
CID 71423787
N-[(E)-1-(2-methoxyphenyl)ethylideneamino]aniline
CID 15349196
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
(2S)-2-amino-2-(2-methoxyphenyl)propan-1-ol
CID 55277390
1-[1-(2-methoxyphenyl)ethylideneamino]-3-methylthiourea
CID 4317161
formaldehyde;bis(1-(2-methoxyphenyl)ethanone)
CID 174959963
1-[(Z)-1,2-dichloroprop-1-enyl]-2-methoxybenzene
CID 118255169
1-[(E)-1,2-bis(2-methoxyphenyl)-2-(2-methylphenyl)ethenyl]-2-methylbenzene
CID 102177255
N-[2-(2-methoxyphenyl)-2-oxoethyl]acetamide
CID 12945637
3-amino-1-(2-methoxyphenyl)-3-methylbutan-1-one
CID 116581224
(2R)-2-hydroxy-1-(2-methoxyphenyl)-2-methylhexane-1,5-dione
CID 101235095

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol?
The IUPAC name of 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol (CID 163590504) is 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol?
The canonical SMILES for 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol is COc1ccccc1/C(C)=N/C(C)(C)CO.
What is the InChIKey of 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol?
The InChIKey is GPDUNTNEFFNACT-GXDHUFHOSA-N. The full InChI is InChI=1S/C13H19NO2/c1-10(14-13(2,3)9-15)11-7-5-6-8-12(11)16-4/h5-8,15H,9H2,1-4H3/b14-10+.
What are the key properties of 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol?
2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol has a molecular weight of 221.30 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methoxyphenyl)ethylideneamino]-2-methylpropan-1-ol is sourced from PubChem (CID 163590504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).