2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide

C23H20N2O4 — CID 135631792

IUPAC2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide
SMILESCc1ccc(C)c(/N=c2\oc3cc(O)ccc3cc2C(=O)NCc2ccco2)c1
InChIInChI=1S/C23H20N2O4/c1-14-5-6-15(2)20(10-14)25-23-19(22(27)24-13-18-4-3-9-28-18)11-16-7-8-17(26)12-21(16)29-23/h3-12,26H,13H2,1-2H3,(H,24,27)/b25-23-
InChIKeyMQKRJZMMWGKYPZ-BZZOAKBMSA-N
MW388.42 g/mol
LogP4.51
Rot. Bonds4

About 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide

2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide (PubChem CID 135631792) has the molecular formula C23H20N2O4 and a molecular weight of 388.42 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide
PubChem CID135631792
Molecular FormulaC23H20N2O4
Molecular Weight388.42 g/mol
Exact Mass388.14
IUPAC Name2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide
SMILESCc1ccc(C)c(/N=c2\oc3cc(O)ccc3cc2C(=O)NCc2ccco2)c1
InChIInChI=1S/C23H20N2O4/c1-14-5-6-15(2)20(10-14)25-23-19(22(27)24-13-18-4-3-9-28-18)11-16-7-8-17(26)12-21(16)29-23/h3-12,26H,13H2,1-2H3,(H,24,27)/b25-23-
InChIKeyMQKRJZMMWGKYPZ-BZZOAKBMSA-N
XLogP4.51
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide
CID 135531856
N-(furan-2-ylmethyl)-7-hydroxy-2-(3-propan-2-ylphenyl)iminochromene-3-carboxamide
CID 135631791
2-(2,3-dimethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
CID 51367522
2-(2,5-dimethylphenyl)imino-7-hydroxy-N-(5-methyl-2-pyridinyl)chromene-3-carboxamide
CID 135631538
N-(furan-2-ylmethyl)-7-hydroxy-2-iminochromene-3-carboxamide
CID 135630907
2-(4-fluorophenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
CID 51367538
2-(3-ethylphenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
CID 51367519
2-(3-fluorophenyl)imino-N-(furan-2-ylmethyl)chromene-3-carboxamide
CID 51367537
2-amino-N-(furan-2-ylmethyl)-5-hydroxybenzamide
CID 107073676
N-(furan-2-ylmethyl)-2,4,5-trimethylbenzamide
CID 95970655
2-(4-fluoro-2-methylphenyl)imino-N-(furan-2-ylmethyl)-8-methoxychromene-3-carboxamide
CID 51368279
2-(2-chloro-4-methylphenyl)imino-7-hydroxy-N-pyridin-2-ylchromene-3-carboxamide
CID 135631517

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide?
The IUPAC name of 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide (CID 135631792) is 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide.
What is the SMILES notation for 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide?
The canonical SMILES for 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide is Cc1ccc(C)c(/N=c2\oc3cc(O)ccc3cc2C(=O)NCc2ccco2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide?
The InChIKey is MQKRJZMMWGKYPZ-BZZOAKBMSA-N. The full InChI is InChI=1S/C23H20N2O4/c1-14-5-6-15(2)20(10-14)25-23-19(22(27)24-13-18-4-3-9-28-18)11-16-7-8-17(26)12-21(16)29-23/h3-12,26H,13H2,1-2H3,(H,24,27)/b25-23-.
What are the key properties of 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide?
2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide has a molecular weight of 388.42 g/mol, XLogP of 4.51, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)imino-N-(furan-2-ylmethyl)-7-hydroxychromene-3-carboxamide is sourced from PubChem (CID 135631792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).