3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide

C20H19NO2 — CID 9104702

IUPAC3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)NCc1ccccc1C
InChIInChI=1S/C20H19NO2/c1-14-7-3-4-10-17(14)13-21-20(22)18-11-15-8-5-6-9-16(15)12-19(18)23-2/h3-12H,13H2,1-2H3,(H,21,22)
InChIKeyMRODCDRKVWWJQJ-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.09
Rot. Bonds4

About 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide

3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide (PubChem CID 9104702) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide
PubChem CID9104702
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC Name3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)NCc1ccccc1C
InChIInChI=1S/C20H19NO2/c1-14-7-3-4-10-17(14)13-21-20(22)18-11-15-8-5-6-9-16(15)12-19(18)23-2/h3-12H,13H2,1-2H3,(H,21,22)
InChIKeyMRODCDRKVWWJQJ-UHFFFAOYSA-N
XLogP4.09
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methoxy-N-[2-[(2-methylphenyl)methylsulfanyl]ethyl]naphthalene-2-carboxamide
CID 92679628
3-methoxy-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]naphthalene-2-carboxamide
CID 9142487
N-[(3-fluoro-4-methylphenyl)methyl]-3-methoxynaphthalene-2-carboxamide
CID 24535452
N-(2-ethyl-6-methylphenyl)-3-methoxynaphthalene-2-carboxamide
CID 801526
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738
3-methoxy-N-(2-methoxyethyl)naphthalene-2-carboxamide
CID 26500862
(2-methylphenyl)methyl 3-methoxynaphthalene-2-carboxylate
CID 7766882
2-(2,5-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 78806562
4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide
CID 110761590
2-(2-methoxy-5-methylphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 9184395
3-methoxy-N-[(3-propan-2-yloxyphenyl)methyl]naphthalene-2-carboxamide
CID 43910398
2-amino-6-methoxy-N-[(2-methylphenyl)methyl]benzamide
CID 81421054

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide (CID 9104702) is 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)NCc1ccccc1C.
What is the InChIKey of 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide?
The InChIKey is MRODCDRKVWWJQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2/c1-14-7-3-4-10-17(14)13-21-20(22)18-11-15-8-5-6-9-16(15)12-19(18)23-2/h3-12H,13H2,1-2H3,(H,21,22).
What are the key properties of 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide?
3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(2-methylphenyl)methyl]naphthalene-2-carboxamide is sourced from PubChem (CID 9104702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).