4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine

C15H12N6 — CID 175888869

IUPAC4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine
SMILESCn1nccc1-c1ccnc2c(-c3ccn[nH]3)nccc12
InChIInChI=1S/C15H12N6/c1-21-13(5-9-19-21)10-2-6-16-14-11(10)3-7-17-15(14)12-4-8-18-20-12/h2-9H,1H3,(H,18,20)
InChIKeyXOKXYAMKUQRRBN-UHFFFAOYSA-N
MW276.30 g/mol
LogP2.42
Rot. Bonds2

About 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine

4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine (PubChem CID 175888869) has the molecular formula C15H12N6 and a molecular weight of 276.30 g/mol. Its IUPAC name is 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine.

Molecular Properties

Compound Name4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine
PubChem CID175888869
Molecular FormulaC15H12N6
Molecular Weight276.30 g/mol
Exact Mass276.11
IUPAC Name4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine
SMILESCn1nccc1-c1ccnc2c(-c3ccn[nH]3)nccc12
InChIInChI=1S/C15H12N6/c1-21-13(5-9-19-21)10-2-6-16-14-11(10)3-7-17-15(14)12-4-8-18-20-12/h2-9H,1H3,(H,18,20)
InChIKeyXOKXYAMKUQRRBN-UHFFFAOYSA-N
XLogP2.42
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine?
The IUPAC name of 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine (CID 175888869) is 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine.
What is the SMILES notation for 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine?
The canonical SMILES for 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine is Cn1nccc1-c1ccnc2c(-c3ccn[nH]3)nccc12.
What is the InChIKey of 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine?
The InChIKey is XOKXYAMKUQRRBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N6/c1-21-13(5-9-19-21)10-2-6-16-14-11(10)3-7-17-15(14)12-4-8-18-20-12/h2-9H,1H3,(H,18,20).
What are the key properties of 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine?
4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine has a molecular weight of 276.30 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridine is sourced from PubChem (CID 175888869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).