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

C22H24N2O4 — CID 22551104

IUPACN-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
SMILESCc1ccc2c(c1)-c1onc(C(=O)N(CCC(C)C)Cc3ccco3)c1CO2
InChIInChI=1S/C22H24N2O4/c1-14(2)8-9-24(12-16-5-4-10-26-16)22(25)20-18-13-27-19-7-6-15(3)11-17(19)21(18)28-23-20/h4-7,10-11,14H,8-9,12-13H2,1-3H3
InChIKeyOIYNOCLESISING-UHFFFAOYSA-N
MW380.44 g/mol
LogP4.82
Rot. Bonds6

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

N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide (PubChem CID 22551104) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
PubChem CID22551104
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC NameN-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
SMILESCc1ccc2c(c1)-c1onc(C(=O)N(CCC(C)C)Cc3ccco3)c1CO2
InChIInChI=1S/C22H24N2O4/c1-14(2)8-9-24(12-16-5-4-10-26-16)22(25)20-18-13-27-19-7-6-15(3)11-17(19)21(18)28-23-20/h4-7,10-11,14H,8-9,12-13H2,1-3H3
InChIKeyOIYNOCLESISING-UHFFFAOYSA-N
XLogP4.82
TPSA68.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide with MolForge

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Related Compounds

N-[2-[[(2R)-butan-2-yl]-(furan-2-ylmethyl)amino]ethyl]-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 92686795
N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 22516668
N-[(2S)-butan-2-yl]-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 92686767
N-(furan-2-ylmethyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 46271745
N-(1,3-benzodioxol-5-ylmethyl)-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 46273683
N-butyl-N-(furan-2-ylmethyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 20923929
N-(2,4-dimethoxyphenyl)-N,8-dimethyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 22551069
N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
CID 20923882
N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide
CID 46273761
N-(furan-2-ylmethyl)-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)-N-(3-morpholin-4-ylpropyl)acetamide
CID 20882237
N-cyclopropyl-N-(furan-2-ylmethyl)-3-methylbenzamide
CID 47022969
N-(3-cyclopentylpropyl)-N-(furan-2-ylmethyl)-4-methylbenzamide
CID 770764

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide (CID 22551104) is N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide is Cc1ccc2c(c1)-c1onc(C(=O)N(CCC(C)C)Cc3ccco3)c1CO2.
What is the InChIKey of N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide?
The InChIKey is OIYNOCLESISING-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c1-14(2)8-9-24(12-16-5-4-10-26-16)22(25)20-18-13-27-19-7-6-15(3)11-17(19)21(18)28-23-20/h4-7,10-11,14H,8-9,12-13H2,1-3H3.
What are the key properties of N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide?
N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide has a molecular weight of 380.44 g/mol, XLogP of 4.82, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-8-methyl-N-(3-methylbutyl)-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide is sourced from PubChem (CID 22551104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).