[4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol

C14H23NO3 — CID 107230997

IUPAC[4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol
SMILESCOCCOCCCNCc1ccc(CO)cc1
InChIInChI=1S/C14H23NO3/c1-17-9-10-18-8-2-7-15-11-13-3-5-14(12-16)6-4-13/h3-6,15-16H,2,7-12H2,1H3
InChIKeyFBZFAHRIHSNKIA-UHFFFAOYSA-N
MW253.34 g/mol
LogP1.32
Rot. Bonds10

About [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol

[4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol (PubChem CID 107230997) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol
PubChem CID107230997
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name[4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol
SMILESCOCCOCCCNCc1ccc(CO)cc1
InChIInChI=1S/C14H23NO3/c1-17-9-10-18-8-2-7-15-11-13-3-5-14(12-16)6-4-13/h3-6,15-16H,2,7-12H2,1H3
InChIKeyFBZFAHRIHSNKIA-UHFFFAOYSA-N
XLogP1.32
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2-methoxyethoxy)-N-(pyridin-4-ylmethyl)propan-1-amine
CID 28720665
4-(2-methoxyethoxy)-N-[(4-propan-2-ylphenyl)methyl]butan-1-amine
CID 115600157
2-[2-(2-methoxyethoxy)ethoxy]-N-[(4-methylphenyl)methyl]ethanamine
CID 104561561
2-[3-[(4-tert-butylphenyl)methylamino]propoxy]ethanol
CID 103992731
[3-[[2-(3-methoxypropoxy)ethylamino]methyl]phenyl]methanol
CID 107230478
4-(2-methoxyethoxy)-N-[(4-prop-2-enoxyphenyl)methyl]butan-1-amine
CID 115600231
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-3-(2-methoxyethoxy)propan-1-amine
CID 60870690
N-[(4-chlorophenyl)methyl]-3-methoxypropan-1-amine;hydrochloride
CID 17206437
[4-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]phenyl]methanol
CID 114127511
3-(2-methoxyethoxy)-N-[(4-methyl-3-nitrophenyl)methyl]propan-1-amine
CID 43225542
N-(isoquinolin-6-ylmethyl)-3-(2-methoxyethoxy)propan-1-amine
CID 107037714
2-methoxy-5-[[3-(2-methoxyethoxy)propylamino]methyl]benzonitrile
CID 65336445

Frequently Asked Questions

What is the IUPAC name of [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol?
The IUPAC name of [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol (CID 107230997) is [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol.
What is the SMILES notation for [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol?
The canonical SMILES for [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol is COCCOCCCNCc1ccc(CO)cc1.
What is the InChIKey of [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol?
The InChIKey is FBZFAHRIHSNKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-17-9-10-18-8-2-7-15-11-13-3-5-14(12-16)6-4-13/h3-6,15-16H,2,7-12H2,1H3.
What are the key properties of [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol?
[4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol has a molecular weight of 253.34 g/mol, XLogP of 1.32, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[3-(2-methoxyethoxy)propylamino]methyl]phenyl]methanol is sourced from PubChem (CID 107230997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).