N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine

C15H16N4S — CID 63993044

IUPACN-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine
SMILESCc1ccsc1C(C)Nc1ccc(-n2cccn2)nc1
InChIInChI=1S/C15H16N4S/c1-11-6-9-20-15(11)12(2)18-13-4-5-14(16-10-13)19-8-3-7-17-19/h3-10,12,18H,1-2H3
InChIKeyXRUHEVWRKGDUAK-UHFFFAOYSA-N
MW284.39 g/mol
LogP3.81
Rot. Bonds4

About N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine

N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine (PubChem CID 63993044) has the molecular formula C15H16N4S and a molecular weight of 284.39 g/mol. Its IUPAC name is N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine
PubChem CID63993044
Molecular FormulaC15H16N4S
Molecular Weight284.39 g/mol
Exact Mass284.11
IUPAC NameN-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine
SMILESCc1ccsc1C(C)Nc1ccc(-n2cccn2)nc1
InChIInChI=1S/C15H16N4S/c1-11-6-9-20-15(11)12(2)18-13-4-5-14(16-10-13)19-8-3-7-17-19/h3-10,12,18H,1-2H3
InChIKeyXRUHEVWRKGDUAK-UHFFFAOYSA-N
XLogP3.81
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.39
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine
CID 65191918
N-(1-phenylpropyl)-6-pyrazol-1-ylpyridin-3-amine
CID 43704473
N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine
CID 115916926
N-[1-(3-methylthiophen-2-yl)ethyl]quinolin-3-amine
CID 63991660
N-heptan-2-yl-6-pyrazol-1-ylpyridin-3-amine
CID 43704213
N-(6-pyrazol-1-yl-3-pyridinyl)acetamide
CID 47153389
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-pyrazol-1-ylpyridin-3-amine
CID 43704477
N-[1-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]-6-pyrazol-1-ylpyridin-3-amine
CID 43783964
3-methyl-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide
CID 25349174
4-(difluoromethylsulfanyl)-N-[1-(3-methylthiophen-2-yl)ethyl]aniline
CID 63993026
3-ethoxy-N-[1-(3-methylthiophen-2-yl)ethyl]aniline
CID 63993267
1-[(2S)-3-methylbutan-2-yl]-3-(6-pyrazol-1-yl-3-pyridinyl)urea
CID 94167183

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine?
The IUPAC name of N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine (CID 63993044) is N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine.
What is the SMILES notation for N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine?
The canonical SMILES for N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine is Cc1ccsc1C(C)Nc1ccc(-n2cccn2)nc1.
What is the InChIKey of N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine?
The InChIKey is XRUHEVWRKGDUAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4S/c1-11-6-9-20-15(11)12(2)18-13-4-5-14(16-10-13)19-8-3-7-17-19/h3-10,12,18H,1-2H3.
What are the key properties of N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine?
N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine has a molecular weight of 284.39 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylthiophen-2-yl)ethyl]-6-pyrazol-1-ylpyridin-3-amine is sourced from PubChem (CID 63993044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).