2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

C16H16N2O3 — CID 61005480

IUPAC2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
SMILESNC(=O)C(Nc1ccccc1)c1ccc2c(c1)OCCO2
InChIInChI=1S/C16H16N2O3/c17-16(19)15(18-12-4-2-1-3-5-12)11-6-7-13-14(10-11)21-9-8-20-13/h1-7,10,15,18H,8-9H2,(H2,17,19)
InChIKeyADQSNMKQRHCMKA-UHFFFAOYSA-N
MW284.31 g/mol
LogP2.10
Rot. Bonds4

About 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide (PubChem CID 61005480) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide.

Molecular Properties

Compound Name2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
PubChem CID61005480
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC Name2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
SMILESNC(=O)C(Nc1ccccc1)c1ccc2c(c1)OCCO2
InChIInChI=1S/C16H16N2O3/c17-16(19)15(18-12-4-2-1-3-5-12)11-6-7-13-14(10-11)21-9-8-20-13/h1-7,10,15,18H,8-9H2,(H2,17,19)
InChIKeyADQSNMKQRHCMKA-UHFFFAOYSA-N
XLogP2.10
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide 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

2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid
CID 60990813
(2R)-2-(2,3-dihydro-1-benzofuran-5-ylamino)-2-phenylacetamide
CID 35626827
2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanol
CID 61046992
2-(4-chloroanilino)-2-(2,3-dihydro-1-benzofuran-5-yl)acetamide
CID 60995769
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-methoxyethylamino)acetamide
CID 62540820
2-anilino-2-phenylacetamide;ethane
CID 142824395
2-anilino-2-(3,4-dimethoxyphenyl)acetamide
CID 61005050
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,3-dihydroxypropanamide
CID 171868354
2-amino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid
CID 4625672
2-anilino-2-(3-methoxyphenyl)acetamide
CID 54889449
2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-2-phenylacetamide
CID 51308725
2-(1,3-benzodioxol-5-yl)-2-(4-fluoroanilino)acetic acid
CID 60992329

Frequently Asked Questions

What is the IUPAC name of 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The IUPAC name of 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide (CID 61005480) is 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide.
What is the SMILES notation for 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The canonical SMILES for 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide is NC(=O)C(Nc1ccccc1)c1ccc2c(c1)OCCO2.
What is the InChIKey of 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The InChIKey is ADQSNMKQRHCMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c17-16(19)15(18-12-4-2-1-3-5-12)11-6-7-13-14(10-11)21-9-8-20-13/h1-7,10,15,18H,8-9H2,(H2,17,19).
What are the key properties of 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide has a molecular weight of 284.31 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide is sourced from PubChem (CID 61005480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).