N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide

C13H18N2O3 — CID 114332328

IUPACN-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide
SMILESO=C(CC1CNCCO1)NCc1ccccc1O
InChIInChI=1S/C13H18N2O3/c16-12-4-2-1-3-10(12)8-15-13(17)7-11-9-14-5-6-18-11/h1-4,11,14,16H,5-9H2,(H,15,17)
InChIKeyDTGOOMBSDQWNJW-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.39
Rot. Bonds4

About N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide

N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide (PubChem CID 114332328) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide
PubChem CID114332328
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide
SMILESO=C(CC1CNCCO1)NCc1ccccc1O
InChIInChI=1S/C13H18N2O3/c16-12-4-2-1-3-10(12)8-15-13(17)7-11-9-14-5-6-18-11/h1-4,11,14,16H,5-9H2,(H,15,17)
InChIKeyDTGOOMBSDQWNJW-UHFFFAOYSA-N
XLogP0.39
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

N-[(3-chloro-2-fluorophenyl)methyl]-2-morpholin-2-ylacetamide
CID 77082307
2-morpholin-2-yl-N-(2-phenylethyl)acetamide
CID 66434342
2-methyl-N-[4-[[(2-morpholin-2-ylacetyl)amino]methyl]phenyl]propanamide
CID 119701228
N-[(5-methylfuran-2-yl)methyl]-2-morpholin-2-ylacetamide
CID 66429169
2-morpholin-2-yl-N-(1,2-oxazol-3-ylmethyl)acetamide
CID 81170232
2-morpholin-2-yl-N-phenylacetamide;hydrochloride
CID 119670265
N-(1,3-benzothiazol-2-ylmethyl)-2-[(2R)-morpholin-2-yl]acetamide
CID 124515478
N-[(3-chloro-1-benzothiophen-2-yl)methyl]-2-[(2S)-morpholin-2-yl]acetamide
CID 125174979
2-(2-methylphenyl)-N-(morpholin-2-ylmethyl)acetamide
CID 43602980
N-[(5-bromothiophen-2-yl)methyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119730032
N-[(4-methoxyphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66434532
N-[(5-ethylthiophen-2-yl)methyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119727879

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide?
The IUPAC name of N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide (CID 114332328) is N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide?
The canonical SMILES for N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide is O=C(CC1CNCCO1)NCc1ccccc1O.
What is the InChIKey of N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide?
The InChIKey is DTGOOMBSDQWNJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c16-12-4-2-1-3-10(12)8-15-13(17)7-11-9-14-5-6-18-11/h1-4,11,14,16H,5-9H2,(H,15,17).
What are the key properties of N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide?
N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide has a molecular weight of 250.30 g/mol, XLogP of 0.39, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide is sourced from PubChem (CID 114332328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).