N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide

C19H20N2O3 — CID 126770468

IUPACN-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide
SMILESCc1cccc(C(C)C)c1NC(=O)Cn1ccc2occc2c1=O
InChIInChI=1S/C19H20N2O3/c1-12(2)14-6-4-5-13(3)18(14)20-17(22)11-21-9-7-16-15(19(21)23)8-10-24-16/h4-10,12H,11H2,1-3H3,(H,20,22)
InChIKeyKODVJRILUOECOT-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.67
Rot. Bonds4

About N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide

N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide (PubChem CID 126770468) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide
PubChem CID126770468
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide
SMILESCc1cccc(C(C)C)c1NC(=O)Cn1ccc2occc2c1=O
InChIInChI=1S/C19H20N2O3/c1-12(2)14-6-4-5-13(3)18(14)20-17(22)11-21-9-7-16-15(19(21)23)8-10-24-16/h4-10,12H,11H2,1-3H3,(H,20,22)
InChIKeyKODVJRILUOECOT-UHFFFAOYSA-N
XLogP3.67
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dimethylphenyl)-2-(1-oxoisoquinolin-2-yl)acetamide
CID 9354354
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CID 82031682
N-(2-methyl-6-propan-2-ylphenyl)-2-(3-oxo-1,2-benzothiazol-2-yl)acetamide
CID 2496717
2-[ethyl(methyl)amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 60516691
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CID 110484715
N-(2-methyl-6-propan-2-ylphenyl)-2-sulfanylacetamide
CID 715390
2-(2,5-dioxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 110686764
2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 23410212
2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride
CID 119674500
2-(4-acetylpiperazin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 8904334
3-(furan-2-yl)-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 18084161
2-[[(1S)-1-(furan-2-yl)ethyl]amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 8918453

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide?
The IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide (CID 126770468) is N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide.
What is the SMILES notation for N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide?
The canonical SMILES for N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide is Cc1cccc(C(C)C)c1NC(=O)Cn1ccc2occc2c1=O.
What is the InChIKey of N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide?
The InChIKey is KODVJRILUOECOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-12(2)14-6-4-5-13(3)18(14)20-17(22)11-21-9-7-16-15(19(21)23)8-10-24-16/h4-10,12H,11H2,1-3H3,(H,20,22).
What are the key properties of N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide?
N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide has a molecular weight of 324.38 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-6-propan-2-ylphenyl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide is sourced from PubChem (CID 126770468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).