N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine

C18H19N5S — CID 175729939

IUPACN-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
SMILESc1ccc(-c2csc(Nc3ccc(N4CCCCC4)cn3)n2)nc1
InChIInChI=1S/C18H19N5S/c1-4-10-23(11-5-1)14-7-8-17(20-12-14)22-18-21-16(13-24-18)15-6-2-3-9-19-15/h2-3,6-9,12-13H,1,4-5,10-11H2,(H,20,21,22)
InChIKeyQXIHBAQQOGJLFR-UHFFFAOYSA-N
MW337.45 g/mol
LogP4.33
Rot. Bonds4

About N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine

N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine (PubChem CID 175729939) has the molecular formula C18H19N5S and a molecular weight of 337.45 g/mol. Its IUPAC name is N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
PubChem CID175729939
Molecular FormulaC18H19N5S
Molecular Weight337.45 g/mol
Exact Mass337.14
IUPAC NameN-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
SMILESc1ccc(-c2csc(Nc3ccc(N4CCCCC4)cn3)n2)nc1
InChIInChI=1S/C18H19N5S/c1-4-10-23(11-5-1)14-7-8-17(20-12-14)22-18-21-16(13-24-18)15-6-2-3-9-19-15/h2-3,6-9,12-13H,1,4-5,10-11H2,(H,20,21,22)
InChIKeyQXIHBAQQOGJLFR-UHFFFAOYSA-N
XLogP4.33
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine (CID 175729939) is N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine is c1ccc(-c2csc(Nc3ccc(N4CCCCC4)cn3)n2)nc1.
What is the InChIKey of N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The InChIKey is QXIHBAQQOGJLFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5S/c1-4-10-23(11-5-1)14-7-8-17(20-12-14)22-18-21-16(13-24-18)15-6-2-3-9-19-15/h2-3,6-9,12-13H,1,4-5,10-11H2,(H,20,21,22).
What are the key properties of N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine has a molecular weight of 337.45 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-piperidin-1-yl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 175729939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).