1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide

C20H24N2O4 — CID 131893315

IUPAC1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(OCC3CCCCO3)cc2)c(=O)n1C
InChIInChI=1S/C20H24N2O4/c1-14-6-11-18(20(24)22(14)2)19(23)21-15-7-9-16(10-8-15)26-13-17-5-3-4-12-25-17/h6-11,17H,3-5,12-13H2,1-2H3,(H,21,23)
InChIKeyPEAZRYRWNPDMMB-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.89
Rot. Bonds5

About 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide

1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide (PubChem CID 131893315) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide
PubChem CID131893315
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(OCC3CCCCO3)cc2)c(=O)n1C
InChIInChI=1S/C20H24N2O4/c1-14-6-11-18(20(24)22(14)2)19(23)21-15-7-9-16(10-8-15)26-13-17-5-3-4-12-25-17/h6-11,17H,3-5,12-13H2,1-2H3,(H,21,23)
InChIKeyPEAZRYRWNPDMMB-UHFFFAOYSA-N
XLogP2.89
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]benzamide
CID 9295083
2,5-dimethyl-N-[4-(oxolan-2-ylmethoxy)phenyl]-1-propan-2-ylpyrrole-3-carboxamide
CID 87020616
4-methyl-N-[4-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 4957909
4-(4-methylpiperazin-1-yl)-N-[4-(oxan-2-ylmethoxy)phenyl]benzamide
CID 131944928
N-(4-acetamidophenyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 40642293
2-[[4-(oxolan-2-ylmethoxy)phenyl]carbamoyl]benzoic acid
CID 4957872
1,3-bis[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]urea
CID 41436663
3-(4-methylpyrazol-1-yl)-N-[4-[[(2R)-oxan-2-yl]methoxy]phenyl]propanamide
CID 164641994
4-(2-methoxyethoxy)-N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]benzamide
CID 40796712
methyl 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzoate
CID 17222269
4-methyl-N-[4-(oxan-2-ylmethoxy)phenyl]-3-oxo-1,4-benzoxazine-6-carboxamide
CID 131916676
2-methylsulfanyl-N-[4-(oxan-2-ylmethoxy)phenyl]-1,3-thiazole-4-carboxamide
CID 131898305

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide (CID 131893315) is 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide is Cc1ccc(C(=O)Nc2ccc(OCC3CCCCO3)cc2)c(=O)n1C.
What is the InChIKey of 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide?
The InChIKey is PEAZRYRWNPDMMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-14-6-11-18(20(24)22(14)2)19(23)21-15-7-9-16(10-8-15)26-13-17-5-3-4-12-25-17/h6-11,17H,3-5,12-13H2,1-2H3,(H,21,23).
What are the key properties of 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide?
1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide has a molecular weight of 356.42 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-N-[4-(oxan-2-ylmethoxy)phenyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 131893315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).