N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide

C23H19NO4 — CID 17450820

IUPACN-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide
SMILESCc1c(-c2ccccc2)oc2c(C(=O)N(C)Cc3ccco3)cccc2c1=O
InChIInChI=1S/C23H19NO4/c1-15-20(25)18-11-6-12-19(23(26)24(2)14-17-10-7-13-27-17)22(18)28-21(15)16-8-4-3-5-9-16/h3-13H,14H2,1-2H3
InChIKeyIYORUAQZVPWSIC-UHFFFAOYSA-N
MW373.41 g/mol
LogP4.63
Rot. Bonds4

About N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide

N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide (PubChem CID 17450820) has the molecular formula C23H19NO4 and a molecular weight of 373.41 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide
PubChem CID17450820
Molecular FormulaC23H19NO4
Molecular Weight373.41 g/mol
Exact Mass373.13
IUPAC NameN-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide
SMILESCc1c(-c2ccccc2)oc2c(C(=O)N(C)Cc3ccco3)cccc2c1=O
InChIInChI=1S/C23H19NO4/c1-15-20(25)18-11-6-12-19(23(26)24(2)14-17-10-7-13-27-17)22(18)28-21(15)16-8-4-3-5-9-16/h3-13H,14H2,1-2H3
InChIKeyIYORUAQZVPWSIC-UHFFFAOYSA-N
XLogP4.63
TPSA63.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide (CID 17450820) is N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide is Cc1c(-c2ccccc2)oc2c(C(=O)N(C)Cc3ccco3)cccc2c1=O.
What is the InChIKey of N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide?
The InChIKey is IYORUAQZVPWSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO4/c1-15-20(25)18-11-6-12-19(23(26)24(2)14-17-10-7-13-27-17)22(18)28-21(15)16-8-4-3-5-9-16/h3-13H,14H2,1-2H3.
What are the key properties of N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide?
N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide has a molecular weight of 373.41 g/mol, XLogP of 4.63, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N,3-dimethyl-4-oxo-2-phenylchromene-8-carboxamide is sourced from PubChem (CID 17450820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).