N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide

C20H19NO4 — CID 7741667

IUPACN-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide
SMILESCOc1cc(NC(=O)c2ccc3ccccc3c2)cc(OC)c1OC
InChIInChI=1S/C20H19NO4/c1-23-17-11-16(12-18(24-2)19(17)25-3)21-20(22)15-9-8-13-6-4-5-7-14(13)10-15/h4-12H,1-3H3,(H,21,22)
InChIKeyCVEIEBOERNEHGJ-UHFFFAOYSA-N
MW337.38 g/mol
LogP4.12
Rot. Bonds5

About N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide

N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide (PubChem CID 7741667) has the molecular formula C20H19NO4 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide
PubChem CID7741667
Molecular FormulaC20H19NO4
Molecular Weight337.38 g/mol
Exact Mass337.13
IUPAC NameN-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide
SMILESCOc1cc(NC(=O)c2ccc3ccccc3c2)cc(OC)c1OC
InChIInChI=1S/C20H19NO4/c1-23-17-11-16(12-18(24-2)19(17)25-3)21-20(22)15-9-8-13-6-4-5-7-14(13)10-15/h4-12H,1-3H3,(H,21,22)
InChIKeyCVEIEBOERNEHGJ-UHFFFAOYSA-N
XLogP4.12
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 4198373
N-[(3,4,5-trimethoxyphenyl)methyl]naphthalene-2-carboxamide
CID 41261586
N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide
CID 5120135
N-(3,4,5-trimethoxyphenyl)quinoline-2-carboxamide
CID 17410358
N-(2,5-dimethoxyphenyl)naphthalene-2-carboxamide
CID 4011159
3-amino-4-methyl-N-(3,4,5-trimethoxyphenyl)benzamide
CID 28723700
4-ethoxy-3-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 26698623
2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 7741659
(3,4,5-trimethoxyphenyl)methyl naphthalene-2-carboxylate
CID 9244590
N-(2-methoxy-6-methylphenyl)naphthalene-2-carboxamide
CID 146497202
4-[4-[(3,4,5-trimethoxyphenyl)carbamoyl]phenoxy]benzamide
CID 56545250
3,4,5-trimethoxy-N-[3-[(3,4,5-trimethoxybenzoyl)amino]phenyl]benzamide
CID 4578304

Frequently Asked Questions

What is the IUPAC name of N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide?
The IUPAC name of N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide (CID 7741667) is N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide?
The canonical SMILES for N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide is COc1cc(NC(=O)c2ccc3ccccc3c2)cc(OC)c1OC.
What is the InChIKey of N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide?
The InChIKey is CVEIEBOERNEHGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO4/c1-23-17-11-16(12-18(24-2)19(17)25-3)21-20(22)15-9-8-13-6-4-5-7-14(13)10-15/h4-12H,1-3H3,(H,21,22).
What are the key properties of N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide?
N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4,5-trimethoxyphenyl)naphthalene-2-carboxamide is sourced from PubChem (CID 7741667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).