5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine

C16H11N5S — CID 11150889

IUPAC5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccccn2)c(-c2ccnc3ncccc23)s1
InChIInChI=1S/C16H11N5S/c17-16-21-13(12-5-1-2-7-18-12)14(22-16)10-6-9-20-15-11(10)4-3-8-19-15/h1-9H,(H2,17,21)
InChIKeyPQGWZYBFJQPWRT-UHFFFAOYSA-N
MW305.37 g/mol
LogP3.40
Rot. Bonds2

About 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine

5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine (PubChem CID 11150889) has the molecular formula C16H11N5S and a molecular weight of 305.37 g/mol. Its IUPAC name is 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine
PubChem CID11150889
Molecular FormulaC16H11N5S
Molecular Weight305.37 g/mol
Exact Mass305.07
IUPAC Name5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccccn2)c(-c2ccnc3ncccc23)s1
InChIInChI=1S/C16H11N5S/c17-16-21-13(12-5-1-2-7-18-12)14(22-16)10-6-9-20-15-11(10)4-3-8-19-15/h1-9H,(H2,17,21)
InChIKeyPQGWZYBFJQPWRT-UHFFFAOYSA-N
XLogP3.40
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine (CID 11150889) is 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine is Nc1nc(-c2ccccn2)c(-c2ccnc3ncccc23)s1.
What is the InChIKey of 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The InChIKey is PQGWZYBFJQPWRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N5S/c17-16-21-13(12-5-1-2-7-18-12)14(22-16)10-6-9-20-15-11(10)4-3-8-19-15/h1-9H,(H2,17,21).
What are the key properties of 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine has a molecular weight of 305.37 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,8-naphthyridin-4-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 11150889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).