N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide

C20H24N2O2 — CID 4878482

IUPACN-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide
SMILESCc1ccc(NC(=O)C(NCC2CCCO2)c2ccccc2)cc1
InChIInChI=1S/C20H24N2O2/c1-15-9-11-17(12-10-15)22-20(23)19(16-6-3-2-4-7-16)21-14-18-8-5-13-24-18/h2-4,6-7,9-12,18-19,21H,5,8,13-14H2,1H3,(H,22,23)
InChIKeyNTFKDVRIEMNYBT-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.44
Rot. Bonds6

About N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide

N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide (PubChem CID 4878482) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide
PubChem CID4878482
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide
SMILESCc1ccc(NC(=O)C(NCC2CCCO2)c2ccccc2)cc1
InChIInChI=1S/C20H24N2O2/c1-15-9-11-17(12-10-15)22-20(23)19(16-6-3-2-4-7-16)21-14-18-8-5-13-24-18/h2-4,6-7,9-12,18-19,21H,5,8,13-14H2,1H3,(H,22,23)
InChIKeyNTFKDVRIEMNYBT-UHFFFAOYSA-N
XLogP3.44
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(3-methylphenyl)-N-(oxolan-2-ylmethyl)oxamide
CID 551256
N-[4-(benzylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 4916601
Tefinostat
CID 15940949
N'-(4-ethylphenyl)-N-(oxolan-2-ylmethyl)oxamide
CID 2883455
1-(4-Methylphenyl)-3-[(tetrahydro-2-furanylmethyl)amino]-2,5-pyrrolidinedione
CID 2889044
N-(3,4-dimethylphenyl)-N'-(tetrahydrofuran-2-ylmethyl)ethanediamide
CID 3136544
1-N-(4-methylphenyl)-2-N-(oxolan-2-ylmethyl)pyrrolidine-1,2-dicarboxamide
CID 3219695
3-benzamido-N-(oxolan-2-ylmethyl)benzamide
CID 3747400
methyl N-{3-methyl-5-[(4-methylphenyl)amino]-5-oxopentanoyl}phenylalaninate
CID 16467950
N-(4-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonyl}phenyl)tetrahydrofuran-2-carboxamide
CID 3236078
N-[4-(butylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 3244920
2-(Benzoylamino)-N-(tetrahydro-2-furanylmethyl)benzamide
CID 570130

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide?
The IUPAC name of N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide (CID 4878482) is N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide.
What is the SMILES notation for N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide?
The canonical SMILES for N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide is Cc1ccc(NC(=O)C(NCC2CCCO2)c2ccccc2)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide?
The InChIKey is NTFKDVRIEMNYBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15-9-11-17(12-10-15)22-20(23)19(16-6-3-2-4-7-16)21-14-18-8-5-13-24-18/h2-4,6-7,9-12,18-19,21H,5,8,13-14H2,1H3,(H,22,23).
What are the key properties of N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide?
N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide has a molecular weight of 324.42 g/mol, XLogP of 3.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide is sourced from PubChem (CID 4878482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).