4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide

C17H18N2O3 — CID 143651021

IUPAC4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide
SMILESCc1cc(COc2ccc(C(N)=O)cc2)c2c(n1)COCC2
InChIInChI=1S/C17H18N2O3/c1-11-8-13(15-6-7-21-10-16(15)19-11)9-22-14-4-2-12(3-5-14)17(18)20/h2-5,8H,6-7,9-10H2,1H3,(H2,18,20)
InChIKeyNDUDFOPVAKAQSL-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.14
Rot. Bonds4

About 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide

4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide (PubChem CID 143651021) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide.

Molecular Properties

Compound Name4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide
PubChem CID143651021
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide
SMILESCc1cc(COc2ccc(C(N)=O)cc2)c2c(n1)COCC2
InChIInChI=1S/C17H18N2O3/c1-11-8-13(15-6-7-21-10-16(15)19-11)9-22-14-4-2-12(3-5-14)17(18)20/h2-5,8H,6-7,9-10H2,1H3,(H2,18,20)
InChIKeyNDUDFOPVAKAQSL-UHFFFAOYSA-N
XLogP2.14
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methoxy]benzamide
CID 63575000
4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxylic acid
CID 62273259
4-[(4-chlorophenoxy)methyl]-3-methylbenzamide
CID 114486227
4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methoxy]benzamide
CID 30591348
4-[(2-methylquinolin-4-yl)methoxy]benzoic acid
CID 22032775
2-[4-[[4-[(2-methylquinolin-4-yl)methoxy]benzoyl]amino]oxan-4-yl]acetic acid
CID 22032786
methyl 2-[[4-[(2-methylquinolin-4-yl)methoxy]benzoyl]amino]-2-(oxan-4-yl)acetate
CID 66912603
4-[(3-fluorophenoxy)methyl]-3-methylbenzamide
CID 114486229
4-[(6-chloro-7-methyl-2-oxochromen-4-yl)methoxy]benzamide
CID 7931369
4-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methoxy]benzamide
CID 26051370
4-[(7,8-dimethyl-2-oxochromen-4-yl)methoxy]benzamide
CID 7931392
2-[4-(2-aminoethoxy)anilino]-6-methylpyridine-4-carboxamide
CID 114770239

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide?
The IUPAC name of 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide (CID 143651021) is 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide.
What is the SMILES notation for 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide?
The canonical SMILES for 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide is Cc1cc(COc2ccc(C(N)=O)cc2)c2c(n1)COCC2.
What is the InChIKey of 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide?
The InChIKey is NDUDFOPVAKAQSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-11-8-13(15-6-7-21-10-16(15)19-11)9-22-14-4-2-12(3-5-14)17(18)20/h2-5,8H,6-7,9-10H2,1H3,(H2,18,20).
What are the key properties of 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide?
4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide has a molecular weight of 298.34 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methyl-6,8-dihydro-5H-pyrano[3,4-b]pyridin-4-yl)methoxy]benzamide is sourced from PubChem (CID 143651021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).