N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide

C15H22N2O3 — CID 79833810

IUPACN-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide
SMILESCc1ccc(NC(=O)CN2CCOC(CO)C2)c(C)c1
InChIInChI=1S/C15H22N2O3/c1-11-3-4-14(12(2)7-11)16-15(19)9-17-5-6-20-13(8-17)10-18/h3-4,7,13,18H,5-6,8-10H2,1-2H3,(H,16,19)
InChIKeyZFHDDZOXQGWNKZ-UHFFFAOYSA-N
MW278.35 g/mol
LogP0.94
Rot. Bonds4

About N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide

N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide (PubChem CID 79833810) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide
PubChem CID79833810
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide
SMILESCc1ccc(NC(=O)CN2CCOC(CO)C2)c(C)c1
InChIInChI=1S/C15H22N2O3/c1-11-3-4-14(12(2)7-11)16-15(19)9-17-5-6-20-13(8-17)10-18/h3-4,7,13,18H,5-6,8-10H2,1-2H3,(H,16,19)
InChIKeyZFHDDZOXQGWNKZ-UHFFFAOYSA-N
XLogP0.94
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(1-aminoethyl)morpholin-4-yl]-N-(2,4-dimethylphenyl)acetamide
CID 81497195
2-[2-(aminomethyl)morpholin-4-yl]-N-(4-chloro-2-methylphenyl)acetamide
CID 114395086
N-(2,6-dibromo-4-methylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide
CID 79835065
N-(2,4-dimethylphenyl)-2-(2-thiophen-3-ylmorpholin-4-yl)acetamide
CID 71920146
N-(2,5-dimethylphenyl)-2-(2-methylmorpholin-4-yl)acetamide
CID 51291532
N-(5-amino-2-fluorophenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide
CID 81206082
2-[4,7-bis(carboxymethyl)-10-[2-(2,4-dimethylanilino)-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 58121003
N-(2,4-dimethylphenyl)-2-[4-(1-hydroxyethyl)piperidin-1-yl]acetamide
CID 103657286
2-[2-(1-aminoethyl)morpholin-4-yl]-N-(2,5-dimethylphenyl)acetamide
CID 81497407
N-(2,4-dimethylphenyl)-2-[4-(oxolan-2-ylmethoxy)piperidin-1-yl]acetamide
CID 71859833
4-[[2-[2-(hydroxymethyl)morpholin-4-yl]acetyl]amino]benzamide
CID 79834650
2-[2-(1-aminoethyl)morpholin-4-yl]-N-(4-chloro-2-methylphenyl)acetamide
CID 81497038

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide (CID 79833810) is N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide is Cc1ccc(NC(=O)CN2CCOC(CO)C2)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide?
The InChIKey is ZFHDDZOXQGWNKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-11-3-4-14(12(2)7-11)16-15(19)9-17-5-6-20-13(8-17)10-18/h3-4,7,13,18H,5-6,8-10H2,1-2H3,(H,16,19).
What are the key properties of N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide?
N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide has a molecular weight of 278.35 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]acetamide is sourced from PubChem (CID 79833810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).