2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide

C16H18N2O4 — CID 14151539

IUPAC2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide
SMILESCC(=O)Nc1oc2ccc(C(C)(C)C)cc2c(=O)c1C(N)=O
InChIInChI=1S/C16H18N2O4/c1-8(19)18-15-12(14(17)21)13(20)10-7-9(16(2,3)4)5-6-11(10)22-15/h5-7H,1-4H3,(H2,17,21)(H,18,19)
InChIKeySVTMJUVCKOJPKH-UHFFFAOYSA-N
MW302.33 g/mol
LogP2.15
Rot. Bonds2

About 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide

2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide (PubChem CID 14151539) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide.

Molecular Properties

Compound Name2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide
PubChem CID14151539
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC Name2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide
SMILESCC(=O)Nc1oc2ccc(C(C)(C)C)cc2c(=O)c1C(N)=O
InChIInChI=1S/C16H18N2O4/c1-8(19)18-15-12(14(17)21)13(20)10-7-9(16(2,3)4)5-6-11(10)22-15/h5-7H,1-4H3,(H2,17,21)(H,18,19)
InChIKeySVTMJUVCKOJPKH-UHFFFAOYSA-N
XLogP2.15
TPSA102.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-acetamido-6-tert-butyl-4-oxochromene-3-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

6-tert-butyl-2-(methylcarbamoylamino)-4-oxochromene-3-carboxamide
CID 14151544
6-tert-butyl-4-oxo-2-(pentylamino)chromene-3-carboxamide
CID 67683025
2,7-ditert-butylxanthen-9-one
CID 10859809
2,8-ditert-butyldibenzofuran
CID 14914466
6-tert-butyl-1,3-benzoxazine-2,4-dione
CID 59410453
6-tert-butyl-4-hydroxychromen-2-one
CID 54694576
N-(9-oxoxanthen-2-yl)acetamide
CID 72793124
5,7-ditert-butyl-9-oxoxanthene-2-carboxylic acid
CID 12825848
N-(4-tert-butylphenyl)-6-chloro-4-oxochromene-2-carboxamide
CID 9203867
4-[4-(4-acetylphenyl)phenyl]-6-tert-butylchromen-2-one
CID 11304022
2-bromo-6-tert-butylxanthen-9-one
CID 146176297
2,7-bis[2-(4-methylphenyl)propan-2-yl]xanthen-9-one
CID 20631276

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide?
The IUPAC name of 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide (CID 14151539) is 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide.
What is the SMILES notation for 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide?
The canonical SMILES for 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide is CC(=O)Nc1oc2ccc(C(C)(C)C)cc2c(=O)c1C(N)=O.
What is the InChIKey of 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide?
The InChIKey is SVTMJUVCKOJPKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-8(19)18-15-12(14(17)21)13(20)10-7-9(16(2,3)4)5-6-11(10)22-15/h5-7H,1-4H3,(H2,17,21)(H,18,19).
What are the key properties of 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide?
2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 2.15, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-6-tert-butyl-4-oxochromene-3-carboxamide is sourced from PubChem (CID 14151539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).