2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol

C12H18N2O3 — CID 83010018

IUPAC2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol
SMILESCOc1cc(CNN2CCOCC2)ccc1O
InChIInChI=1S/C12H18N2O3/c1-16-12-8-10(2-3-11(12)15)9-13-14-4-6-17-7-5-14/h2-3,8,13,15H,4-7,9H2,1H3
InChIKeyVKGWBNCGUGTYMA-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.74
Rot. Bonds4

About 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol

2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol (PubChem CID 83010018) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol
PubChem CID83010018
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol
SMILESCOc1cc(CNN2CCOCC2)ccc1O
InChIInChI=1S/C12H18N2O3/c1-16-12-8-10(2-3-11(12)15)9-13-14-4-6-17-7-5-14/h2-3,8,13,15H,4-7,9H2,1H3
InChIKeyVKGWBNCGUGTYMA-UHFFFAOYSA-N
XLogP0.74
TPSA53.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-4-[[1-(oxan-4-yl)ethylamino]methyl]phenol
CID 103779359
N-[(3,5-dimethoxyphenyl)methyl]morpholin-4-amine
CID 83011668
N-[(5-bromo-2-methoxyphenyl)methyl]morpholin-4-amine
CID 83009516
N-[(4-hydroxy-3-methoxyphenyl)methyl]azocane-1-carboxamide
CID 121497136
N-[(4-iodophenyl)methyl]morpholin-4-amine
CID 83022461
2-methoxy-4-[[2-(oxolan-3-yl)ethylamino]methyl]phenol
CID 102671737
N-[(3-bromo-4-chlorophenyl)methyl]morpholin-4-amine
CID 83230853
2-methoxy-4-[(3-pyrrolidin-1-ylpropylamino)methyl]phenol
CID 28657716
4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]-2-methoxyphenol
CID 114399658
5-(dimethylsulfamoyl)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-2-morpholin-4-ylbenzamide
CID 55638218
4-[(3-ethylpentan-3-ylamino)methyl]-2-methoxyphenol
CID 65039215
4-[[(4-bromophenyl)methylamino]methyl]-2-methoxyphenol
CID 60735101

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol?
The IUPAC name of 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol (CID 83010018) is 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol.
What is the SMILES notation for 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol?
The canonical SMILES for 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol is COc1cc(CNN2CCOCC2)ccc1O.
What is the InChIKey of 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol?
The InChIKey is VKGWBNCGUGTYMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-16-12-8-10(2-3-11(12)15)9-13-14-4-6-17-7-5-14/h2-3,8,13,15H,4-7,9H2,1H3.
What are the key properties of 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol?
2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol has a molecular weight of 238.29 g/mol, XLogP of 0.74, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[(morpholin-4-ylamino)methyl]phenol is sourced from PubChem (CID 83010018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).