N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide

C15H22N2O2 — CID 55014055

IUPACN-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide
SMILESCc1ccc(NC(=O)CNCC2CCCCO2)cc1
InChIInChI=1S/C15H22N2O2/c1-12-5-7-13(8-6-12)17-15(18)11-16-10-14-4-2-3-9-19-14/h5-8,14,16H,2-4,9-11H2,1H3,(H,17,18)
InChIKeyOKYBKAKBOUOYTP-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.09
Rot. Bonds5

About N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide

N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide (PubChem CID 55014055) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide
PubChem CID55014055
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide
SMILESCc1ccc(NC(=O)CNCC2CCCCO2)cc1
InChIInChI=1S/C15H22N2O2/c1-12-5-7-13(8-6-12)17-15(18)11-16-10-14-4-2-3-9-19-14/h5-8,14,16H,2-4,9-11H2,1H3,(H,17,18)
InChIKeyOKYBKAKBOUOYTP-UHFFFAOYSA-N
XLogP2.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 54815392
N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-(oxolan-2-ylmethylamino)acetamide
CID 119677925
N-methyl-4-[[2-(oxolan-2-ylmethylamino)acetyl]amino]benzamide
CID 54815292
N-(4-iodophenyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119672668
N-(4-methylsulfanylphenyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119694259
N'-(4-methylphenyl)-N-(oxolan-2-ylmethyl)propanediamide
CID 108943682
N-[4-(4-methylpiperidin-1-yl)phenyl]-2-(oxolan-2-ylmethylamino)acetamide
CID 108994306
N-[(4-methylphenyl)methyl]-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119677338
2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
CID 28566911
2-(oxolan-2-ylmethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 119672849
N-(3,4-dichlorophenyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119670892
2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide
CID 64911376

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide?
The IUPAC name of N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide (CID 55014055) is N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide.
What is the SMILES notation for N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide?
The canonical SMILES for N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide is Cc1ccc(NC(=O)CNCC2CCCCO2)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide?
The InChIKey is OKYBKAKBOUOYTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12-5-7-13(8-6-12)17-15(18)11-16-10-14-4-2-3-9-19-14/h5-8,14,16H,2-4,9-11H2,1H3,(H,17,18).
What are the key properties of N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide?
N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide is sourced from PubChem (CID 55014055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).