4,8-dimethoxynaphthalene-1,5-dicarboxamide

C14H14N2O4 — CID 100971321

IUPAC4,8-dimethoxynaphthalene-1,5-dicarboxamide
SMILESCOc1ccc(C(N)=O)c2c(OC)ccc(C(N)=O)c12
InChIInChI=1S/C14H14N2O4/c1-19-9-5-3-8(14(16)18)12-10(20-2)6-4-7(11(9)12)13(15)17/h3-6H,1-2H3,(H2,15,17)(H2,16,18)
InChIKeyDEAKQGQBBDVXLI-UHFFFAOYSA-N
MW274.28 g/mol
LogP1.05
Rot. Bonds4

About 4,8-dimethoxynaphthalene-1,5-dicarboxamide

4,8-dimethoxynaphthalene-1,5-dicarboxamide (PubChem CID 100971321) has the molecular formula C14H14N2O4 and a molecular weight of 274.28 g/mol. Its IUPAC name is 4,8-dimethoxynaphthalene-1,5-dicarboxamide.

Molecular Properties

Compound Name4,8-dimethoxynaphthalene-1,5-dicarboxamide
PubChem CID100971321
Molecular FormulaC14H14N2O4
Molecular Weight274.28 g/mol
Exact Mass274.10
IUPAC Name4,8-dimethoxynaphthalene-1,5-dicarboxamide
SMILESCOc1ccc(C(N)=O)c2c(OC)ccc(C(N)=O)c12
InChIInChI=1S/C14H14N2O4/c1-19-9-5-3-8(14(16)18)12-10(20-2)6-4-7(11(9)12)13(15)17/h3-6H,1-2H3,(H2,15,17)(H2,16,18)
InChIKeyDEAKQGQBBDVXLI-UHFFFAOYSA-N
XLogP1.05
TPSA104.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

8-methoxy-2,4-dimethylquinoline-5-carboxamide
CID 82573973
1,4,5,8-tetramethoxynaphthalene-2-carboxamide
CID 15362247
4-chloro-2-methoxybenzamide
CID 19741766
6-carbamoyl-2,3-dimethoxybenzoic acid
CID 90976735
2-methoxy-4-(trifluoromethyl)benzamide
CID 3788214
2-ethoxy-3,4-dimethoxybenzamide
CID 141309813
4-methoxy-6-methylpyridine-3-carboxamide
CID 69278952
2,5-dimethoxy-4-methylbenzamide
CID 82491295
1,4,5,8-tetramethoxynaphthalene
CID 10220551
2-methoxy-4-(2-oxopropoxy)benzamide
CID 91220438
3-cyano-2-formyl-4-methoxybenzamide
CID 171013101
3-carbamoyl-4-methoxybenzenesulfinic acid
CID 130538060

Frequently Asked Questions

What is the IUPAC name of 4,8-dimethoxynaphthalene-1,5-dicarboxamide?
The IUPAC name of 4,8-dimethoxynaphthalene-1,5-dicarboxamide (CID 100971321) is 4,8-dimethoxynaphthalene-1,5-dicarboxamide.
What is the SMILES notation for 4,8-dimethoxynaphthalene-1,5-dicarboxamide?
The canonical SMILES for 4,8-dimethoxynaphthalene-1,5-dicarboxamide is COc1ccc(C(N)=O)c2c(OC)ccc(C(N)=O)c12.
What is the InChIKey of 4,8-dimethoxynaphthalene-1,5-dicarboxamide?
The InChIKey is DEAKQGQBBDVXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4/c1-19-9-5-3-8(14(16)18)12-10(20-2)6-4-7(11(9)12)13(15)17/h3-6H,1-2H3,(H2,15,17)(H2,16,18).
What are the key properties of 4,8-dimethoxynaphthalene-1,5-dicarboxamide?
4,8-dimethoxynaphthalene-1,5-dicarboxamide has a molecular weight of 274.28 g/mol, XLogP of 1.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-dimethoxynaphthalene-1,5-dicarboxamide is sourced from PubChem (CID 100971321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).