6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol

C15H15N5OS — CID 136929515

IUPAC6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol
SMILESOc1cnc2ccc(Nc3nnc(C4CCCC4)s3)nc2c1
InChIInChI=1S/C15H15N5OS/c21-10-7-12-11(16-8-10)5-6-13(17-12)18-15-20-19-14(22-15)9-3-1-2-4-9/h5-9,21H,1-4H2,(H,17,18,20)
InChIKeyKNVXEPMSNXHCMO-UHFFFAOYSA-N
MW313.39 g/mol
LogP3.59
Rot. Bonds3

About 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol

6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol (PubChem CID 136929515) has the molecular formula C15H15N5OS and a molecular weight of 313.39 g/mol. Its IUPAC name is 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol.

Molecular Properties

Compound Name6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol
PubChem CID136929515
Molecular FormulaC15H15N5OS
Molecular Weight313.39 g/mol
Exact Mass313.10
IUPAC Name6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol
SMILESOc1cnc2ccc(Nc3nnc(C4CCCC4)s3)nc2c1
InChIInChI=1S/C15H15N5OS/c21-10-7-12-11(16-8-10)5-6-13(17-12)18-15-20-19-14(22-15)9-3-1-2-4-9/h5-9,21H,1-4H2,(H,17,18,20)
InChIKeyKNVXEPMSNXHCMO-UHFFFAOYSA-N
XLogP3.59
TPSA83.82 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.39
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol?
The IUPAC name of 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol (CID 136929515) is 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol.
What is the SMILES notation for 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol?
The canonical SMILES for 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol is Oc1cnc2ccc(Nc3nnc(C4CCCC4)s3)nc2c1.
What is the InChIKey of 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol?
The InChIKey is KNVXEPMSNXHCMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5OS/c21-10-7-12-11(16-8-10)5-6-13(17-12)18-15-20-19-14(22-15)9-3-1-2-4-9/h5-9,21H,1-4H2,(H,17,18,20).
What are the key properties of 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol?
6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol has a molecular weight of 313.39 g/mol, XLogP of 3.59, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-cyclopentyl-1,3,4-thiadiazol-2-yl)amino]-1,5-naphthyridin-3-ol is sourced from PubChem (CID 136929515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).