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

C14H10N2OS — CID 780357

IUPACN-(1,3-thiazol-2-yl)naphthalene-2-carboxamide
SMILESO=C(Nc1nccs1)c1ccc2ccccc2c1
InChIInChI=1S/C14H10N2OS/c17-13(16-14-15-7-8-18-14)12-6-5-10-3-1-2-4-11(10)9-12/h1-9H,(H,15,16,17)
InChIKeyKKFQXWRVYFMDOH-UHFFFAOYSA-N
MW254.31 g/mol
LogP3.55
Rot. Bonds2

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

N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide (PubChem CID 780357) has the molecular formula C14H10N2OS and a molecular weight of 254.31 g/mol. Its IUPAC name is N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(1,3-thiazol-2-yl)naphthalene-2-carboxamide
PubChem CID780357
Molecular FormulaC14H10N2OS
Molecular Weight254.31 g/mol
Exact Mass254.05
IUPAC NameN-(1,3-thiazol-2-yl)naphthalene-2-carboxamide
SMILESO=C(Nc1nccs1)c1ccc2ccccc2c1
InChIInChI=1S/C14H10N2OS/c17-13(16-14-15-7-8-18-14)12-6-5-10-3-1-2-4-11(10)9-12/h1-9H,(H,15,16,17)
InChIKeyKKFQXWRVYFMDOH-UHFFFAOYSA-N
XLogP3.55
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide?
The IUPAC name of N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide (CID 780357) is N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide?
The canonical SMILES for N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide is O=C(Nc1nccs1)c1ccc2ccccc2c1.
What is the InChIKey of N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide?
The InChIKey is KKFQXWRVYFMDOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2OS/c17-13(16-14-15-7-8-18-14)12-6-5-10-3-1-2-4-11(10)9-12/h1-9H,(H,15,16,17).
What are the key properties of N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide?
N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide has a molecular weight of 254.31 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-2-yl)naphthalene-2-carboxamide is sourced from PubChem (CID 780357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).