N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide

C13H9NO4 — CID 618277

IUPACN-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide
SMILESCc1cc(=O)oc2c1cc(NC=O)c1occc12
InChIInChI=1S/C13H9NO4/c1-7-4-11(16)18-12-8-2-3-17-13(8)10(14-6-15)5-9(7)12/h2-6H,1H3,(H,14,15)
InChIKeyPBZLKXQVBARLEQ-UHFFFAOYSA-N
MW243.22 g/mol
LogP2.42
Rot. Bonds2

About N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide

N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide (PubChem CID 618277) has the molecular formula C13H9NO4 and a molecular weight of 243.22 g/mol. Its IUPAC name is N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide.

Molecular Properties

Compound NameN-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide
PubChem CID618277
Molecular FormulaC13H9NO4
Molecular Weight243.22 g/mol
Exact Mass243.05
IUPAC NameN-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide
SMILESCc1cc(=O)oc2c1cc(NC=O)c1occc12
InChIInChI=1S/C13H9NO4/c1-7-4-11(16)18-12-8-2-3-17-13(8)10(14-6-15)5-9(7)12/h2-6H,1H3,(H,14,15)
InChIKeyPBZLKXQVBARLEQ-UHFFFAOYSA-N
XLogP2.42
TPSA72.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.22
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'cumarine', 'substructure': 'N/A'}

Analyze N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide 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

9-ethyl-5-methylfuro[3,2-g]chromen-7-one
CID 23459775
4-methylpyrano[2,3-f]chromene-2,8-dione
CID 13165001
6-chloro-4,9-dimethylfuro[2,3-h]chromen-2-one
CID 102406727
4,10-dimethylpyrano[2,3-f]chromene-2,8-dione
CID 1234115
6-ethyl-7-hydroxy-4-methyl-2-oxochromene-8-carbaldehyde
CID 102598102
4-methoxy-7-methyl-1-benzofuran-5-carbaldehyde
CID 82374430
4,5-dimethylfuro[3,2-g]chromen-7-one
CID 22367452
8-iodo-4-methylchromen-2-one
CID 130067017
N-[9-(4-chloroanilino)-4-methyl-2-oxofuro[2,3-h]chromen-6-yl]acetamide
CID 633348
3-tert-butyl-5,9-dimethylfuro[3,2-g]chromen-7-one
CID 907312
2-hydroxy-N-(4-methyl-2-oxochromen-8-yl)acetamide
CID 91296883
4-methyl-8-propan-2-ylchromen-2-one
CID 71446036

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide?
The IUPAC name of N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide (CID 618277) is N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide.
What is the SMILES notation for N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide?
The canonical SMILES for N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide is Cc1cc(=O)oc2c1cc(NC=O)c1occc12.
What is the InChIKey of N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide?
The InChIKey is PBZLKXQVBARLEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NO4/c1-7-4-11(16)18-12-8-2-3-17-13(8)10(14-6-15)5-9(7)12/h2-6H,1H3,(H,14,15).
What are the key properties of N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide?
N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide has a molecular weight of 243.22 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-oxofuro[2,3-h]chromen-6-yl)formamide is sourced from PubChem (CID 618277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).