3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide

C16H14N2O2S — CID 2551174

IUPAC3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)Nc1nc(C)cs1
InChIInChI=1S/C16H14N2O2S/c1-10-9-21-16(17-10)18-15(19)13-7-11-5-3-4-6-12(11)8-14(13)20-2/h3-9H,1-2H3,(H,17,18,19)
InChIKeyLTNMHPUPVIAWJB-UHFFFAOYSA-N
MW298.37 g/mol
LogP3.87
Rot. Bonds3

About 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide

3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide (PubChem CID 2551174) has the molecular formula C16H14N2O2S and a molecular weight of 298.37 g/mol. Its IUPAC name is 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide
PubChem CID2551174
Molecular FormulaC16H14N2O2S
Molecular Weight298.37 g/mol
Exact Mass298.08
IUPAC Name3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)Nc1nc(C)cs1
InChIInChI=1S/C16H14N2O2S/c1-10-9-21-16(17-10)18-15(19)13-7-11-5-3-4-6-12(11)8-14(13)20-2/h3-9H,1-2H3,(H,17,18,19)
InChIKeyLTNMHPUPVIAWJB-UHFFFAOYSA-N
XLogP3.87
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-[4-(5-methylfuran-2-yl)-1,3-thiazol-2-yl]naphthalene-2-carboxamide
CID 5075767
5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 2679160
2,3-dimethoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 2970631
N-(4,6-dimethylpyrimidin-2-yl)-3-methoxynaphthalene-2-carboxamide
CID 802722
3-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)-1H-pyrazole-5-carboxamide
CID 121084015
3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 17425685
2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 46557524
2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 884818
6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-2-oxochromene-3-carboxamide
CID 4913043
2-(difluoromethoxy)-3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 51158639
3-chloro-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 17361583
2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 2085562

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide (CID 2551174) is 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)Nc1nc(C)cs1.
What is the InChIKey of 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide?
The InChIKey is LTNMHPUPVIAWJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2S/c1-10-9-21-16(17-10)18-15(19)13-7-11-5-3-4-6-12(11)8-14(13)20-2/h3-9H,1-2H3,(H,17,18,19).
What are the key properties of 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide?
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide has a molecular weight of 298.37 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide is sourced from PubChem (CID 2551174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).