2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine

C19H15N5 — CID 10335725

IUPAC2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine
SMILESc1ccc(-c2nn3c(c2-c2ccc4ncccc4n2)CCC3)nc1
InChIInChI=1S/C19H15N5/c1-2-10-21-16(5-1)19-18(17-7-4-12-24(17)23-19)15-9-8-13-14(22-15)6-3-11-20-13/h1-3,5-6,8-11H,4,7,12H2
InChIKeyMDRKIOBOVPZAIG-UHFFFAOYSA-N
MW313.36 g/mol
LogP3.50
Rot. Bonds2

About 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine

2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine (PubChem CID 10335725) has the molecular formula C19H15N5 and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine.

Molecular Properties

Compound Name2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine
PubChem CID10335725
Molecular FormulaC19H15N5
Molecular Weight313.36 g/mol
Exact Mass313.13
IUPAC Name2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine
SMILESc1ccc(-c2nn3c(c2-c2ccc4ncccc4n2)CCC3)nc1
InChIInChI=1S/C19H15N5/c1-2-10-21-16(5-1)19-18(17-7-4-12-24(17)23-19)15-9-8-13-14(22-15)6-3-11-20-13/h1-3,5-6,8-11H,4,7,12H2
InChIKeyMDRKIOBOVPZAIG-UHFFFAOYSA-N
XLogP3.50
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine?
The IUPAC name of 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine (CID 10335725) is 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine.
What is the SMILES notation for 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine?
The canonical SMILES for 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine is c1ccc(-c2nn3c(c2-c2ccc4ncccc4n2)CCC3)nc1.
What is the InChIKey of 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine?
The InChIKey is MDRKIOBOVPZAIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5/c1-2-10-21-16(5-1)19-18(17-7-4-12-24(17)23-19)15-9-8-13-14(22-15)6-3-11-20-13/h1-3,5-6,8-11H,4,7,12H2.
What are the key properties of 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine?
2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine has a molecular weight of 313.36 g/mol, XLogP of 3.50, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1,5-naphthyridine is sourced from PubChem (CID 10335725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).