2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide

C23H20N2O3 — CID 51367522

IUPAC2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
SMILESCc1cccc(/N=c2\oc3ccccc3cc2C(=O)NCc2ccco2)c1C
InChIInChI=1S/C23H20N2O3/c1-15-7-5-10-20(16(15)2)25-23-19(13-17-8-3-4-11-21(17)28-23)22(26)24-14-18-9-6-12-27-18/h3-13H,14H2,1-2H3,(H,24,26)/b25-23-
InChIKeyLMCJEOIDHXLISR-BZZOAKBMSA-N
MW372.42 g/mol
LogP4.81
Rot. Bonds4

About 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide

2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide (PubChem CID 51367522) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide.

Molecular Properties

Compound Name2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
PubChem CID51367522
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
SMILESCc1cccc(/N=c2\oc3ccccc3cc2C(=O)NCc2ccco2)c1C
InChIInChI=1S/C23H20N2O3/c1-15-7-5-10-20(16(15)2)25-23-19(13-17-8-3-4-11-21(17)28-23)22(26)24-14-18-9-6-12-27-18/h3-13H,14H2,1-2H3,(H,24,26)/b25-23-
InChIKeyLMCJEOIDHXLISR-BZZOAKBMSA-N
XLogP4.81
TPSA67.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide?
The IUPAC name of 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide (CID 51367522) is 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide.
What is the SMILES notation for 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide?
The canonical SMILES for 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide is Cc1cccc(/N=c2\oc3ccccc3cc2C(=O)NCc2ccco2)c1C.
What is the InChIKey of 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide?
The InChIKey is LMCJEOIDHXLISR-BZZOAKBMSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-15-7-5-10-20(16(15)2)25-23-19(13-17-8-3-4-11-21(17)28-23)22(26)24-14-18-9-6-12-27-18/h3-13H,14H2,1-2H3,(H,24,26)/b25-23-.
What are the key properties of 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide?
2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide has a molecular weight of 372.42 g/mol, XLogP of 4.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide is sourced from PubChem (CID 51367522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).