N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine

C17H18N6S — CID 141154333

IUPACN-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine
SMILESc1cc(Nc2cnccn2)nc(-c2cnc(N3CCCCC3)s2)c1
InChIInChI=1S/C17H18N6S/c1-2-9-23(10-3-1)17-20-11-14(24-17)13-5-4-6-15(21-13)22-16-12-18-7-8-19-16/h4-8,11-12H,1-3,9-10H2,(H,19,21,22)
InChIKeyUKARTRMCSHOFEW-UHFFFAOYSA-N
MW338.44 g/mol
LogP3.73
Rot. Bonds4

About N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine

N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine (PubChem CID 141154333) has the molecular formula C17H18N6S and a molecular weight of 338.44 g/mol. Its IUPAC name is N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine
PubChem CID141154333
Molecular FormulaC17H18N6S
Molecular Weight338.44 g/mol
Exact Mass338.13
IUPAC NameN-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine
SMILESc1cc(Nc2cnccn2)nc(-c2cnc(N3CCCCC3)s2)c1
InChIInChI=1S/C17H18N6S/c1-2-9-23(10-3-1)17-20-11-14(24-17)13-5-4-6-15(21-13)22-16-12-18-7-8-19-16/h4-8,11-12H,1-3,9-10H2,(H,19,21,22)
InChIKeyUKARTRMCSHOFEW-UHFFFAOYSA-N
XLogP3.73
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.44
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine?
The IUPAC name of N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine (CID 141154333) is N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine.
What is the SMILES notation for N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine?
The canonical SMILES for N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine is c1cc(Nc2cnccn2)nc(-c2cnc(N3CCCCC3)s2)c1.
What is the InChIKey of N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine?
The InChIKey is UKARTRMCSHOFEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6S/c1-2-9-23(10-3-1)17-20-11-14(24-17)13-5-4-6-15(21-13)22-16-12-18-7-8-19-16/h4-8,11-12H,1-3,9-10H2,(H,19,21,22).
What are the key properties of N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine?
N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine has a molecular weight of 338.44 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-piperidin-1-yl-1,3-thiazol-5-yl)-2-pyridinyl]pyrazin-2-amine is sourced from PubChem (CID 141154333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).