5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride

C14H13ClN4OS — CID 75469410

IUPAC5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride
SMILESCN(C(=O)c1nnsc1N)c1ccc2ccccc2c1.Cl
InChIInChI=1S/C14H12N4OS.ClH/c1-18(14(19)12-13(15)20-17-16-12)11-7-6-9-4-2-3-5-10(9)8-11;/h2-8H,15H2,1H3;1H
InChIKeyAZRRCDOPDCVELQ-UHFFFAOYSA-N
MW320.81 g/mol
LogP2.97
Rot. Bonds2

About 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride

5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride (PubChem CID 75469410) has the molecular formula C14H13ClN4OS and a molecular weight of 320.81 g/mol. Its IUPAC name is 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride
PubChem CID75469410
Molecular FormulaC14H13ClN4OS
Molecular Weight320.81 g/mol
Exact Mass320.05
IUPAC Name5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride
SMILESCN(C(=O)c1nnsc1N)c1ccc2ccccc2c1.Cl
InChIInChI=1S/C14H12N4OS.ClH/c1-18(14(19)12-13(15)20-17-16-12)11-7-6-9-4-2-3-5-10(9)8-11;/h2-8H,15H2,1H3;1H
InChIKeyAZRRCDOPDCVELQ-UHFFFAOYSA-N
XLogP2.97
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.81
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-naphthalen-2-ylnaphthalene-2-carboxamide
CID 26904267
N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide
CID 51146862
N-(3-aminophenyl)-N-methylnaphthalene-2-carboxamide
CID 61296378
N,3-dimethyl-N-naphthalen-2-yl-4-oxophthalazine-1-carboxamide
CID 18270358
N-methyl-N-naphthalen-2-yl-4-oxo-3-phenylphthalazine-1-carboxamide
CID 26904232
N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide
CID 55757695
4-[methyl(naphthalene-2-carbonyl)amino]benzoic acid
CID 44726898
5-chloro-N-methyl-N-naphthalen-2-yl-2-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 55770857
4-(methoxymethyl)-N-methyl-N-naphthalen-2-ylbenzamide
CID 51175212
N,1,3-trimethyl-N-naphthalen-2-ylthieno[3,2-d]pyrazole-5-carboxamide
CID 51312757
3-(methoxymethyl)-N-methyl-N-naphthalen-2-ylbenzamide
CID 51201003
N-methyl-N-oxidonaphthalen-2-amine
CID 163543073

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride?
The IUPAC name of 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride (CID 75469410) is 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride.
What is the SMILES notation for 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride?
The canonical SMILES for 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride is CN(C(=O)c1nnsc1N)c1ccc2ccccc2c1.Cl.
What is the InChIKey of 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride?
The InChIKey is AZRRCDOPDCVELQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4OS.ClH/c1-18(14(19)12-13(15)20-17-16-12)11-7-6-9-4-2-3-5-10(9)8-11;/h2-8H,15H2,1H3;1H.
What are the key properties of 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride?
5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride has a molecular weight of 320.81 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 75469410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).