[3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol

C15H25NO2 — CID 62018767

IUPAC[3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol
SMILESCCCN(CCC)Cc1cc(CO)ccc1OC
InChIInChI=1S/C15H25NO2/c1-4-8-16(9-5-2)11-14-10-13(12-17)6-7-15(14)18-3/h6-7,10,17H,4-5,8-9,11-12H2,1-3H3
InChIKeyBRMUWFKJZKJZER-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.81
Rot. Bonds8

About [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol

[3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol (PubChem CID 62018767) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol.

Molecular Properties

Compound Name[3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol
PubChem CID62018767
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name[3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol
SMILESCCCN(CCC)Cc1cc(CO)ccc1OC
InChIInChI=1S/C15H25NO2/c1-4-8-16(9-5-2)11-14-10-13(12-17)6-7-15(14)18-3/h6-7,10,17H,4-5,8-9,11-12H2,1-3H3
InChIKeyBRMUWFKJZKJZER-UHFFFAOYSA-N
XLogP2.81
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-bromo-2-methoxyphenyl)methyl]-N-propylpropan-1-amine
CID 55026913
[3-[[2-(dimethylamino)ethyl-(2-methylpropyl)amino]methyl]-4-methoxyphenyl]methanol
CID 62019689
2-[(5-bromo-2,4-dimethoxyphenyl)methyl-propylamino]ethanol
CID 30981796
N-[[5-(aminomethyl)-2-methoxyphenyl]methyl]-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 62019836
[3-[[benzyl(methyl)amino]methyl]-4-methoxyphenyl]methanol
CID 62019327
N-[[5-(aminomethyl)-2-methoxyphenyl]methyl]-N-(cyclopropylmethyl)propan-1-amine
CID 62017800
N-(2-bromoethyl)-N-[(3,4-dimethoxyphenyl)methyl]propan-1-amine
CID 80680489
[3-(2-ethoxyethoxymethyl)-4-methoxyphenyl]methanol
CID 62019338
[3-[5-(hydroxymethyl)-2-methoxyphenyl]-4-methoxyphenyl]methanol
CID 642903
[4-methoxy-3-(propan-2-yloxymethyl)phenyl]methanol
CID 62019697
2-[(5-bromo-2-methoxyphenyl)methyl-(2-hydroxyethyl)amino]ethanol
CID 30983525
4-[(dipropylamino)methyl]-2,6-dimethoxyphenol;hydrochloride
CID 45259533

Frequently Asked Questions

What is the IUPAC name of [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol?
The IUPAC name of [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol (CID 62018767) is [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol.
What is the SMILES notation for [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol?
The canonical SMILES for [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol is CCCN(CCC)Cc1cc(CO)ccc1OC.
What is the InChIKey of [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol?
The InChIKey is BRMUWFKJZKJZER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-4-8-16(9-5-2)11-14-10-13(12-17)6-7-15(14)18-3/h6-7,10,17H,4-5,8-9,11-12H2,1-3H3.
What are the key properties of [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol?
[3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol has a molecular weight of 251.37 g/mol, XLogP of 2.81, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(dipropylamino)methyl]-4-methoxyphenyl]methanol is sourced from PubChem (CID 62018767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).