2-[2-(diethylaminomethyl)phenyl]propan-1-ol

C14H23NO — CID 117317101

IUPAC2-[2-(diethylaminomethyl)phenyl]propan-1-ol
SMILESCCN(CC)Cc1ccccc1C(C)CO
InChIInChI=1S/C14H23NO/c1-4-15(5-2)10-13-8-6-7-9-14(13)12(3)11-16/h6-9,12,16H,4-5,10-11H2,1-3H3
InChIKeyITWDVFQQVBWGRZ-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.62
Rot. Bonds6

About 2-[2-(diethylaminomethyl)phenyl]propan-1-ol

2-[2-(diethylaminomethyl)phenyl]propan-1-ol (PubChem CID 117317101) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-[2-(diethylaminomethyl)phenyl]propan-1-ol.

Molecular Properties

Compound Name2-[2-(diethylaminomethyl)phenyl]propan-1-ol
PubChem CID117317101
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-[2-(diethylaminomethyl)phenyl]propan-1-ol
SMILESCCN(CC)Cc1ccccc1C(C)CO
InChIInChI=1S/C14H23NO/c1-4-15(5-2)10-13-8-6-7-9-14(13)12(3)11-16/h6-9,12,16H,4-5,10-11H2,1-3H3
InChIKeyITWDVFQQVBWGRZ-UHFFFAOYSA-N
XLogP2.62
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(fluoromethyl)phenyl]propan-1-ol
CID 117276627
2-[2-(2,2-difluoroethyl)phenyl]propan-1-ol
CID 117289377
2-[2-(2,2-difluoropropyl)phenyl]propan-1-ol
CID 117305573
2-ethyl-6-(1-hydroxypropan-2-yl)phenol
CID 117278483
[2-[2-(diethylaminomethyl)phenyl]sulfanylphenyl]methanol;hydrochloride
CID 70624243
(2S)-2-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]-3-methylbutanamide
CID 61259162
cadmium(2+);bis(2-(diethylaminomethyl)benzeneselenolate)
CID 102048772
2-(diethylaminomethyl)-N-(2-methylpropyl)aniline
CID 43729309
3-[2-[(dimethylamino)methyl]phenyl]butanal
CID 117293878
2-[2-(diethylaminomethyl)phenyl]ethanethioamide
CID 82135813
2-chloro-N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide
CID 43346662
1-[[2-(aminomethyl)phenyl]methyl-ethylamino]propan-2-ol
CID 65278136

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylaminomethyl)phenyl]propan-1-ol?
The IUPAC name of 2-[2-(diethylaminomethyl)phenyl]propan-1-ol (CID 117317101) is 2-[2-(diethylaminomethyl)phenyl]propan-1-ol.
What is the SMILES notation for 2-[2-(diethylaminomethyl)phenyl]propan-1-ol?
The canonical SMILES for 2-[2-(diethylaminomethyl)phenyl]propan-1-ol is CCN(CC)Cc1ccccc1C(C)CO.
What is the InChIKey of 2-[2-(diethylaminomethyl)phenyl]propan-1-ol?
The InChIKey is ITWDVFQQVBWGRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-4-15(5-2)10-13-8-6-7-9-14(13)12(3)11-16/h6-9,12,16H,4-5,10-11H2,1-3H3.
What are the key properties of 2-[2-(diethylaminomethyl)phenyl]propan-1-ol?
2-[2-(diethylaminomethyl)phenyl]propan-1-ol has a molecular weight of 221.34 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylaminomethyl)phenyl]propan-1-ol is sourced from PubChem (CID 117317101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).