N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine

C11H15N5S — CID 105150034

IUPACN-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine
SMILESCCCNC(c1cnccn1)c1snnc1C
InChIInChI=1S/C11H15N5S/c1-3-4-14-10(9-7-12-5-6-13-9)11-8(2)15-16-17-11/h5-7,10,14H,3-4H2,1-2H3
InChIKeyPIASZDWLCXBJLC-UHFFFAOYSA-N
MW249.34 g/mol
LogP1.73
Rot. Bonds5

About N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine

N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine (PubChem CID 105150034) has the molecular formula C11H15N5S and a molecular weight of 249.34 g/mol. Its IUPAC name is N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine.

Molecular Properties

Compound NameN-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine
PubChem CID105150034
Molecular FormulaC11H15N5S
Molecular Weight249.34 g/mol
Exact Mass249.10
IUPAC NameN-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine
SMILESCCCNC(c1cnccn1)c1snnc1C
InChIInChI=1S/C11H15N5S/c1-3-4-14-10(9-7-12-5-6-13-9)11-8(2)15-16-17-11/h5-7,10,14H,3-4H2,1-2H3
InChIKeyPIASZDWLCXBJLC-UHFFFAOYSA-N
XLogP1.73
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine
CID 105150036
N-[isoquinolin-8-yl-(4-methylthiadiazol-5-yl)methyl]propan-1-amine
CID 103137746
(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethanol
CID 105099110
N-[(4-tert-butylthiadiazol-5-yl)-pyrazin-2-ylmethyl]ethanamine
CID 105149972
N-[(6-methyl-2-pyridinyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 63970482
N-[(3,5-dichlorophenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 115860582
N-[(4-ethylphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 62542571
N-[(3-methylphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 60819603
[(4-ethylthiadiazol-5-yl)-pyrazin-2-ylmethyl]hydrazine
CID 105308737
N-[(4-methoxyphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 60819950
N-[(3-bromo-4-methylphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 115860589
N-[(4-methylthiadiazol-5-yl)-quinolin-7-ylmethyl]propan-1-amine
CID 105172648

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine?
The IUPAC name of N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine (CID 105150034) is N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine.
What is the SMILES notation for N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine?
The canonical SMILES for N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine is CCCNC(c1cnccn1)c1snnc1C.
What is the InChIKey of N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine?
The InChIKey is PIASZDWLCXBJLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5S/c1-3-4-14-10(9-7-12-5-6-13-9)11-8(2)15-16-17-11/h5-7,10,14H,3-4H2,1-2H3.
What are the key properties of N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine?
N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine has a molecular weight of 249.34 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine is sourced from PubChem (CID 105150034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).