N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine

C10H13N5S — CID 105150036

IUPACN-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine
SMILESCCCNC(c1cnccn1)c1cnns1
InChIInChI=1S/C10H13N5S/c1-2-3-13-10(9-7-14-15-16-9)8-6-11-4-5-12-8/h4-7,10,13H,2-3H2,1H3
InChIKeyKZQMGYPBHGFBLB-UHFFFAOYSA-N
MW235.32 g/mol
LogP1.42
Rot. Bonds5

About N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine

N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine (PubChem CID 105150036) has the molecular formula C10H13N5S and a molecular weight of 235.32 g/mol. Its IUPAC name is N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine
PubChem CID105150036
Molecular FormulaC10H13N5S
Molecular Weight235.32 g/mol
Exact Mass235.09
IUPAC NameN-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine
SMILESCCCNC(c1cnccn1)c1cnns1
InChIInChI=1S/C10H13N5S/c1-2-3-13-10(9-7-14-15-16-9)8-6-11-4-5-12-8/h4-7,10,13H,2-3H2,1H3
InChIKeyKZQMGYPBHGFBLB-UHFFFAOYSA-N
XLogP1.42
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.32
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethyl]propan-1-amine
CID 105150034
N-[(3-methoxypyrazin-2-yl)-(thiadiazol-5-yl)methyl]propan-1-amine
CID 105178702
N-[(4-ethylphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 62542571
N-[(3,5-dichlorophenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 115860582
N-[(4-methoxyphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 60819950
N-[(6-methyl-2-pyridinyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 63970482
N-[quinolin-6-yl(thiadiazol-5-yl)methyl]propan-1-amine
CID 105172388
N-[(2-methylthiophen-3-yl)-(thiadiazol-5-yl)methyl]propan-1-amine
CID 102840891
N-(2,2-difluoro-1-pyrazin-2-ylethyl)propan-1-amine
CID 103759753
N-[(3-bromo-2-pyridinyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 113398557
N-[(3-methylphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 60819603
4,4,4-trifluoro-N-propyl-1-pyrazin-2-ylbutan-1-amine
CID 64567832

Frequently Asked Questions

What is the IUPAC name of N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine?
The IUPAC name of N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine (CID 105150036) is N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine?
The canonical SMILES for N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine is CCCNC(c1cnccn1)c1cnns1.
What is the InChIKey of N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine?
The InChIKey is KZQMGYPBHGFBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5S/c1-2-3-13-10(9-7-14-15-16-9)8-6-11-4-5-12-8/h4-7,10,13H,2-3H2,1H3.
What are the key properties of N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine?
N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine has a molecular weight of 235.32 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[pyrazin-2-yl(thiadiazol-5-yl)methyl]propan-1-amine is sourced from PubChem (CID 105150036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).