6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine

C19H20N10O — CID 173484287

IUPAC6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine
SMILESNN=Nc1c(-c2n[nH]c(-c3ccco3)n2)cnn1CCN1CCc2ncccc2C1
InChIInChI=1S/C19H20N10O/c20-27-26-19-14(17-23-18(25-24-17)16-4-2-10-30-16)11-22-29(19)9-8-28-7-5-15-13(12-28)3-1-6-21-15/h1-4,6,10-11H,5,7-9,12H2,(H2,20,26)(H,23,24,25)
InChIKeyDAPCVFCBTQIWOG-UHFFFAOYSA-N
MW404.44 g/mol
LogP2.34
Rot. Bonds6

About 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine

6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 173484287) has the molecular formula C19H20N10O and a molecular weight of 404.44 g/mol. Its IUPAC name is 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID173484287
Molecular FormulaC19H20N10O
Molecular Weight404.44 g/mol
Exact Mass404.18
IUPAC Name6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine
SMILESNN=Nc1c(-c2n[nH]c(-c3ccco3)n2)cnn1CCN1CCc2ncccc2C1
InChIInChI=1S/C19H20N10O/c20-27-26-19-14(17-23-18(25-24-17)16-4-2-10-30-16)11-22-29(19)9-8-28-7-5-15-13(12-28)3-1-6-21-15/h1-4,6,10-11H,5,7-9,12H2,(H2,20,26)(H,23,24,25)
InChIKeyDAPCVFCBTQIWOG-UHFFFAOYSA-N
XLogP2.34
TPSA139.40 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.44
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine (CID 173484287) is 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine is NN=Nc1c(-c2n[nH]c(-c3ccco3)n2)cnn1CCN1CCc2ncccc2C1.
What is the InChIKey of 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is DAPCVFCBTQIWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N10O/c20-27-26-19-14(17-23-18(25-24-17)16-4-2-10-30-16)11-22-29(19)9-8-28-7-5-15-13(12-28)3-1-6-21-15/h1-4,6,10-11H,5,7-9,12H2,(H2,20,26)(H,23,24,25).
What are the key properties of 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine?
6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 404.44 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[5-(aminodiazenyl)-4-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]pyrazol-1-yl]ethyl]-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 173484287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).