5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide

C15H21N3O3 — CID 120669246

IUPAC5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide
SMILESCc1ccc(C(N)C(=O)NCC2CCC(C(N)=O)O2)cc1
InChIInChI=1S/C15H21N3O3/c1-9-2-4-10(5-3-9)13(16)15(20)18-8-11-6-7-12(21-11)14(17)19/h2-5,11-13H,6-8,16H2,1H3,(H2,17,19)(H,18,20)
InChIKeyOMGXHRVMVTYZOK-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.14
Rot. Bonds5

About 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide

5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide (PubChem CID 120669246) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide
PubChem CID120669246
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide
SMILESCc1ccc(C(N)C(=O)NCC2CCC(C(N)=O)O2)cc1
InChIInChI=1S/C15H21N3O3/c1-9-2-4-10(5-3-9)13(16)15(20)18-8-11-6-7-12(21-11)14(17)19/h2-5,11-13H,6-8,16H2,1H3,(H2,17,19)(H,18,20)
InChIKeyOMGXHRVMVTYZOK-UHFFFAOYSA-N
XLogP0.14
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide 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

5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxylic acid
CID 106312530
5-[[[(2S)-2-amino-4-methylpentanoyl]amino]methyl]oxolane-2-carboxamide
CID 119822338
2-amino-N-[(3-methylcyclohexyl)methyl]-2-(4-methylphenyl)acetamide
CID 106151415
2-amino-N-[(4-methylmorpholin-2-yl)methyl]-2-(4-methylphenyl)acetamide
CID 106312498
5-[[[(2S)-2-amino-3-phenylpropanoyl]amino]methyl]oxolane-2-carboxamide;hydrochloride
CID 119345646
2-amino-N-(2-amino-2-oxoethyl)-2-(4-methylphenyl)acetamide
CID 106151324
2-amino-N-(2-cyclopropylethyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668581
2-amino-N-[(1-ethylpiperidin-4-yl)methyl]-2-(4-methylphenyl)acetamide
CID 106151685
2-amino-2-(4-methylphenyl)-N-[2-(4-methylphenyl)propyl]acetamide
CID 120668682
2-amino-2-(4-methylphenyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]acetamide
CID 120669400
5-[[2-(5-chlorothiophen-2-yl)propanoylamino]methyl]oxolane-2-carboxamide
CID 71851839
2-amino-N-(2-aminoethyl)-2-(4-methylphenyl)acetamide
CID 106151018

Frequently Asked Questions

What is the IUPAC name of 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide?
The IUPAC name of 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide (CID 120669246) is 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide.
What is the SMILES notation for 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide?
The canonical SMILES for 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide is Cc1ccc(C(N)C(=O)NCC2CCC(C(N)=O)O2)cc1.
What is the InChIKey of 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide?
The InChIKey is OMGXHRVMVTYZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-9-2-4-10(5-3-9)13(16)15(20)18-8-11-6-7-12(21-11)14(17)19/h2-5,11-13H,6-8,16H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide?
5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.14, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]oxolane-2-carboxamide is sourced from PubChem (CID 120669246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).