[3-(2,2-dimethylpropylamino)phenyl]methanol

C12H19NO — CID 20785829

IUPAC[3-(2,2-dimethylpropylamino)phenyl]methanol
SMILESCC(C)(C)CNc1cccc(CO)c1
InChIInChI=1S/C12H19NO/c1-12(2,3)9-13-11-6-4-5-10(7-11)8-14/h4-7,13-14H,8-9H2,1-3H3
InChIKeyLUXLQEVPNPSHDE-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.64
Rot. Bonds3

About [3-(2,2-dimethylpropylamino)phenyl]methanol

[3-(2,2-dimethylpropylamino)phenyl]methanol (PubChem CID 20785829) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is [3-(2,2-dimethylpropylamino)phenyl]methanol.

Molecular Properties

Compound Name[3-(2,2-dimethylpropylamino)phenyl]methanol
PubChem CID20785829
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name[3-(2,2-dimethylpropylamino)phenyl]methanol
SMILESCC(C)(C)CNc1cccc(CO)c1
InChIInChI=1S/C12H19NO/c1-12(2,3)9-13-11-6-4-5-10(7-11)8-14/h4-7,13-14H,8-9H2,1-3H3
InChIKeyLUXLQEVPNPSHDE-UHFFFAOYSA-N
XLogP2.64
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,3-N-bis(2,2-dimethylpropyl)benzene-1,3-diamine;bis(trimethylalumane)
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[3-(2-ethylbutylamino)phenyl]methanol
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[3-(2,2-difluoroethylamino)phenyl]methanol
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2-bromo-N-[3-(hydroxymethyl)phenyl]-2-methylpropanamide
CID 82110089
[3-(2,2-dimethylpropyl)phenyl]methanol
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[3-[(2-methylcyclopropyl)methylamino]phenyl]methanol
CID 130874904
2-ethyl-2-[(3-ethylanilino)methyl]butan-1-ol
CID 81411805
1-chloro-3-[3-(hydroxymethyl)anilino]propan-2-ol
CID 168636282
[3-[(3-methyl-2-phenylbutyl)amino]phenyl]methanol
CID 107875961
4-[[3-(hydroxymethyl)anilino]methyl]benzene-1,2-diol
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CID 61319500

Frequently Asked Questions

What is the IUPAC name of [3-(2,2-dimethylpropylamino)phenyl]methanol?
The IUPAC name of [3-(2,2-dimethylpropylamino)phenyl]methanol (CID 20785829) is [3-(2,2-dimethylpropylamino)phenyl]methanol.
What is the SMILES notation for [3-(2,2-dimethylpropylamino)phenyl]methanol?
The canonical SMILES for [3-(2,2-dimethylpropylamino)phenyl]methanol is CC(C)(C)CNc1cccc(CO)c1.
What is the InChIKey of [3-(2,2-dimethylpropylamino)phenyl]methanol?
The InChIKey is LUXLQEVPNPSHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-12(2,3)9-13-11-6-4-5-10(7-11)8-14/h4-7,13-14H,8-9H2,1-3H3.
What are the key properties of [3-(2,2-dimethylpropylamino)phenyl]methanol?
[3-(2,2-dimethylpropylamino)phenyl]methanol has a molecular weight of 193.29 g/mol, XLogP of 2.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,2-dimethylpropylamino)phenyl]methanol is sourced from PubChem (CID 20785829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).