6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide

C27H25NO4 — CID 2257718

IUPAC6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(-c3ccc(C)cc3)c3cc(OC)c(OC)cc3c2)cc1
InChIInChI=1S/C27H25NO4/c1-17-5-7-18(8-6-17)23-14-20(27(29)28-21-9-11-22(30-2)12-10-21)13-19-15-25(31-3)26(32-4)16-24(19)23/h5-16H,1-4H3,(H,28,29)
InChIKeyYUBUTXNIFIPAGU-UHFFFAOYSA-N
MW427.50 g/mol
LogP6.09
Rot. Bonds6

About 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide

6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide (PubChem CID 2257718) has the molecular formula C27H25NO4 and a molecular weight of 427.50 g/mol. Its IUPAC name is 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide
PubChem CID2257718
Molecular FormulaC27H25NO4
Molecular Weight427.50 g/mol
Exact Mass427.18
IUPAC Name6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(-c3ccc(C)cc3)c3cc(OC)c(OC)cc3c2)cc1
InChIInChI=1S/C27H25NO4/c1-17-5-7-18(8-6-17)23-14-20(27(29)28-21-9-11-22(30-2)12-10-21)13-19-15-25(31-3)26(32-4)16-24(19)23/h5-16H,1-4H3,(H,28,29)
InChIKeyYUBUTXNIFIPAGU-UHFFFAOYSA-N
XLogP6.09
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.50
LogP ≤ 56.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6,7-dimethoxy-N-(2-methylphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide
CID 21209585
N-(3-chloro-2-methylphenyl)-6,7-dimethoxy-4-(4-methylphenyl)naphthalene-2-carboxamide
CID 21209594
6,7-dimethoxy-4-(4-methylphenyl)-N-(2-phenylethyl)naphthalene-2-carboxamide
CID 21209618
3,5-dimethoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 2092676
6-methoxy-N-[3-methoxy-4-(4-methoxyphenyl)phenyl]naphthalene-2-carboxamide
CID 57401328
N-(4-methoxyphenyl)-4-(4-methylphenoxy)benzamide
CID 16651033
6-methoxy-N-[4-(4-methoxyphenyl)phenyl]naphthalene-2-carboxamide
CID 57392645
4-methoxy-1-N,3-N-bis(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 71608233
[4-[(4-methylphenyl)carbamoyl]phenyl] 3,4,5-trimethoxybenzoate
CID 1193343
3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
N-[4-(3,4-dimethoxyanilino)phenyl]-4-methoxybenzamide
CID 112987995
3,5-dibromo-N-(4-methoxyphenyl)benzamide
CID 114023535

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide?
The IUPAC name of 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide (CID 2257718) is 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide.
What is the SMILES notation for 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide?
The canonical SMILES for 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide is COc1ccc(NC(=O)c2cc(-c3ccc(C)cc3)c3cc(OC)c(OC)cc3c2)cc1.
What is the InChIKey of 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide?
The InChIKey is YUBUTXNIFIPAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25NO4/c1-17-5-7-18(8-6-17)23-14-20(27(29)28-21-9-11-22(30-2)12-10-21)13-19-15-25(31-3)26(32-4)16-24(19)23/h5-16H,1-4H3,(H,28,29).
What are the key properties of 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide?
6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide has a molecular weight of 427.50 g/mol, XLogP of 6.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-N-(4-methoxyphenyl)-4-(4-methylphenyl)naphthalene-2-carboxamide is sourced from PubChem (CID 2257718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).