2-(2-methylanilino)-2-(oxolan-2-yl)acetamide

C13H18N2O2 — CID 82836748

IUPAC2-(2-methylanilino)-2-(oxolan-2-yl)acetamide
SMILESCc1ccccc1NC(C(N)=O)C1CCCO1
InChIInChI=1S/C13H18N2O2/c1-9-5-2-3-6-10(9)15-12(13(14)16)11-7-4-8-17-11/h2-3,5-6,11-12,15H,4,7-8H2,1H3,(H2,14,16)
InChIKeyKUNYVJGBPRNVET-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.44
Rot. Bonds4

About 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide

2-(2-methylanilino)-2-(oxolan-2-yl)acetamide (PubChem CID 82836748) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-methylanilino)-2-(oxolan-2-yl)acetamide
PubChem CID82836748
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-(2-methylanilino)-2-(oxolan-2-yl)acetamide
SMILESCc1ccccc1NC(C(N)=O)C1CCCO1
InChIInChI=1S/C13H18N2O2/c1-9-5-2-3-6-10(9)15-12(13(14)16)11-7-4-8-17-11/h2-3,5-6,11-12,15H,4,7-8H2,1H3,(H2,14,16)
InChIKeyKUNYVJGBPRNVET-UHFFFAOYSA-N
XLogP1.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluoroanilino)-2-(oxolan-2-yl)acetamide
CID 82836977
2-cyclohexyl-2-(2-methylanilino)acetamide
CID 54892248
2-(3-methoxyanilino)-2-(oxolan-2-yl)acetamide
CID 82838220
N-(2-methylphenyl)-2-[1-(oxolan-2-yl)ethylamino]propanamide
CID 75504701
2-(cyclopropylamino)-2-(oxolan-2-yl)acetamide
CID 82837879
2-(oxolan-2-yl)-2-(oxolan-2-ylmethylamino)acetamide
CID 82837199
4-[(2-methylphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 75871245
3-methyl-2-(2-methylanilino)butanamide
CID 60679565
ethyl 2-(4-bromoanilino)-2-(oxolan-2-yl)acetate
CID 82838120
methyl 2-(4-fluoroanilino)-2-(oxolan-2-yl)acetate
CID 82836869
methyl 2-cyclohex-3-en-1-yl-2-(2-methylanilino)acetate
CID 54889816
N'-(2-methylphenyl)-N-(oxolan-2-ylmethyl)propanediamide
CID 108943680

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide?
The IUPAC name of 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide (CID 82836748) is 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide?
The canonical SMILES for 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide is Cc1ccccc1NC(C(N)=O)C1CCCO1.
What is the InChIKey of 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide?
The InChIKey is KUNYVJGBPRNVET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-5-2-3-6-10(9)15-12(13(14)16)11-7-4-8-17-11/h2-3,5-6,11-12,15H,4,7-8H2,1H3,(H2,14,16).
What are the key properties of 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide?
2-(2-methylanilino)-2-(oxolan-2-yl)acetamide has a molecular weight of 234.30 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylanilino)-2-(oxolan-2-yl)acetamide is sourced from PubChem (CID 82836748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).