N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine

C16H16N2S — CID 43680346

IUPACN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine
SMILESCc1nc(C(C)Nc2ccc3ccccc3c2)cs1
InChIInChI=1S/C16H16N2S/c1-11(16-10-19-12(2)18-16)17-15-8-7-13-5-3-4-6-14(13)9-15/h3-11,17H,1-2H3
InChIKeyWOUBKEYKFHIJHX-UHFFFAOYSA-N
MW268.39 g/mol
LogP4.78
Rot. Bonds3

About N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine

N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine (PubChem CID 43680346) has the molecular formula C16H16N2S and a molecular weight of 268.39 g/mol. Its IUPAC name is N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine.

Molecular Properties

Compound NameN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine
PubChem CID43680346
Molecular FormulaC16H16N2S
Molecular Weight268.39 g/mol
Exact Mass268.10
IUPAC NameN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine
SMILESCc1nc(C(C)Nc2ccc3ccccc3c2)cs1
InChIInChI=1S/C16H16N2S/c1-11(16-10-19-12(2)18-16)17-15-8-7-13-5-3-4-6-14(13)9-15/h3-11,17H,1-2H3
InChIKeyWOUBKEYKFHIJHX-UHFFFAOYSA-N
XLogP4.78
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.39
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-phenylaniline
CID 43716894
3,4-dichloro-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]aniline
CID 43670072
3-fluoro-4-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]aniline
CID 43670116
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,3-dihydro-1H-inden-5-amine
CID 43670073
4-N,4-N-dimethyl-1-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzene-1,4-diamine
CID 43670343
5-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]isoindole-1,3-dione
CID 43670137
2,2-dimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-1,3-benzodioxol-5-amine
CID 43676344
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine
CID 66351418
2-methylsulfanyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]aniline
CID 43683530
N-[2-methyl-4-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]phenyl]acetamide
CID 43672908
2-methyl-4-[1-[3-(sulfamoylamino)anilino]ethyl]-1,3-thiazole
CID 43742065
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-propylaniline
CID 43670202

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine?
The IUPAC name of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine (CID 43680346) is N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine.
What is the SMILES notation for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine?
The canonical SMILES for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine is Cc1nc(C(C)Nc2ccc3ccccc3c2)cs1.
What is the InChIKey of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine?
The InChIKey is WOUBKEYKFHIJHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2S/c1-11(16-10-19-12(2)18-16)17-15-8-7-13-5-3-4-6-14(13)9-15/h3-11,17H,1-2H3.
What are the key properties of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine?
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine has a molecular weight of 268.39 g/mol, XLogP of 4.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine is sourced from PubChem (CID 43680346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).