N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide

C17H15NOS — CID 51146862

IUPACN,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)N(C)c2ccc3ccccc3c2)s1
InChIInChI=1S/C17H15NOS/c1-12-7-10-16(20-12)17(19)18(2)15-9-8-13-5-3-4-6-14(13)11-15/h3-11H,1-2H3
InChIKeyKHQKXWHSMQASAI-UHFFFAOYSA-N
MW281.38 g/mol
LogP4.49
Rot. Bonds2

About N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide

N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide (PubChem CID 51146862) has the molecular formula C17H15NOS and a molecular weight of 281.38 g/mol. Its IUPAC name is N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide
PubChem CID51146862
Molecular FormulaC17H15NOS
Molecular Weight281.38 g/mol
Exact Mass281.09
IUPAC NameN,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)N(C)c2ccc3ccccc3c2)s1
InChIInChI=1S/C17H15NOS/c1-12-7-10-16(20-12)17(19)18(2)15-9-8-13-5-3-4-6-14(13)11-15/h3-11H,1-2H3
InChIKeyKHQKXWHSMQASAI-UHFFFAOYSA-N
XLogP4.49
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.38
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-naphthalen-2-ylnaphthalene-2-carboxamide
CID 26904267
N,1,3-trimethyl-N-naphthalen-2-ylthieno[3,2-d]pyrazole-5-carboxamide
CID 51312757
N-(4-cyanophenyl)-N,5-dimethylthiophene-2-carboxamide
CID 55141574
5-amino-N-methyl-N-naphthalen-2-ylthiadiazole-4-carboxamide;hydrochloride
CID 75469410
N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide
CID 55757695
4-[methyl(naphthalene-2-carbonyl)amino]benzoic acid
CID 44726898
4-(methoxymethyl)-N-methyl-N-naphthalen-2-ylbenzamide
CID 51175212
N-(3-aminophenyl)-N-methylnaphthalene-2-carboxamide
CID 61296378
N-methyl-N-(3-methylphenyl)-5-(4-methylphenyl)thiophene-2-carboxamide
CID 118716518
N,5-dimethylthiophene-2-carbohydrazide
CID 90946987
3-(methoxymethyl)-N-methyl-N-naphthalen-2-ylbenzamide
CID 51201003
N-[[4-(dimethylamino)phenyl]methyl]-N,5-dimethylthiophene-2-carboxamide
CID 78800736

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide?
The IUPAC name of N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide (CID 51146862) is N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide.
What is the SMILES notation for N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide?
The canonical SMILES for N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide is Cc1ccc(C(=O)N(C)c2ccc3ccccc3c2)s1.
What is the InChIKey of N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide?
The InChIKey is KHQKXWHSMQASAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NOS/c1-12-7-10-16(20-12)17(19)18(2)15-9-8-13-5-3-4-6-14(13)11-15/h3-11H,1-2H3.
What are the key properties of N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide?
N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide has a molecular weight of 281.38 g/mol, XLogP of 4.49, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide is sourced from PubChem (CID 51146862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).