N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide

C19H15N3O4 — CID 46273722

IUPACN-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
SMILESCc1ccc2c(c1)-c1onc(C(=O)Nc3ccccc3C(N)=O)c1CO2
InChIInChI=1S/C19H15N3O4/c1-10-6-7-15-12(8-10)17-13(9-25-15)16(22-26-17)19(24)21-14-5-3-2-4-11(14)18(20)23/h2-8H,9H2,1H3,(H2,20,23)(H,21,24)
InChIKeyGGFOFXSUAPFGME-UHFFFAOYSA-N
MW349.35 g/mol
LogP2.89
Rot. Bonds3

About N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide

N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide (PubChem CID 46273722) has the molecular formula C19H15N3O4 and a molecular weight of 349.35 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
PubChem CID46273722
Molecular FormulaC19H15N3O4
Molecular Weight349.35 g/mol
Exact Mass349.11
IUPAC NameN-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
SMILESCc1ccc2c(c1)-c1onc(C(=O)Nc3ccccc3C(N)=O)c1CO2
InChIInChI=1S/C19H15N3O4/c1-10-6-7-15-12(8-10)17-13(9-25-15)16(22-26-17)19(24)21-14-5-3-2-4-11(14)18(20)23/h2-8H,9H2,1H3,(H2,20,23)(H,21,24)
InChIKeyGGFOFXSUAPFGME-UHFFFAOYSA-N
XLogP2.89
TPSA107.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.35
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

8-methyl-N-(6-methyl-2-pyridinyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 46273621
8-methyl-N-[3-(trifluoromethyl)phenyl]-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 46273627
N-[(2S)-butan-2-yl]-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 92686767
N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 46273761
N-(1,3-benzodioxol-5-ylmethyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 46273683
N-pyridin-3-yl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 46271796
1-(2-bromo-4-methylphenyl)-3-(4H-chromeno[3,4-d][1,2]oxazol-3-yl)urea
CID 22550212
N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 48528626
N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 22551104
N-cyclopentyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 53003547
4-amino-N-(2-carbamoylphenyl)-1,2,5-oxadiazole-3-carboxamide
CID 62688483
5-(4,5-dihydrobenzo[g][1,2]benzoxazole-3-carbonylamino)benzene-1,3-dicarboxamide
CID 167989756

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide?
The IUPAC name of N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide (CID 46273722) is N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide is Cc1ccc2c(c1)-c1onc(C(=O)Nc3ccccc3C(N)=O)c1CO2.
What is the InChIKey of N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide?
The InChIKey is GGFOFXSUAPFGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O4/c1-10-6-7-15-12(8-10)17-13(9-25-15)16(22-26-17)19(24)21-14-5-3-2-4-11(14)18(20)23/h2-8H,9H2,1H3,(H2,20,23)(H,21,24).
What are the key properties of N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide?
N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide has a molecular weight of 349.35 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide is sourced from PubChem (CID 46273722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).