4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine

C9H8N4 — CID 149253861

IUPAC4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine
SMILESC1=CC2=CC3=NN=CC3NC2N=C1
InChIInChI=1S/C9H8N4/c1-2-6-4-7-8(5-11-13-7)12-9(6)10-3-1/h1-5,8-9,12H
InChIKeyASLUDLGSDUKZRU-UHFFFAOYSA-N
MW172.19 g/mol
LogP0.29
Rot. Bonds

About 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine

4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine (PubChem CID 149253861) has the molecular formula C9H8N4 and a molecular weight of 172.19 g/mol. Its IUPAC name is 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine.

Molecular Properties

Compound Name4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine
PubChem CID149253861
Molecular FormulaC9H8N4
Molecular Weight172.19 g/mol
Exact Mass172.07
IUPAC Name4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine
SMILESC1=CC2=CC3=NN=CC3NC2N=C1
InChIInChI=1S/C9H8N4/c1-2-6-4-7-8(5-11-13-7)12-9(6)10-3-1/h1-5,8-9,12H
InChIKeyASLUDLGSDUKZRU-UHFFFAOYSA-N
XLogP0.29
TPSA49.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.19
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine with MolForge

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

Launch Full Analysis

Related Compounds

8-(Difluoromethyl)-1,2-dihydropyrrolo[3,2-i]quinoline
CID 153411019
2,7a-dihydro-1H-cyclopenta[d]pyrimidine
CID 21891858
2,5-dihydro-1H-pyrimido[5,4-c]carbazole
CID 87663759
1,2,6,8a-Tetrahydroquinazoline
CID 91089711
1,2,6,8a-Tetrahydro-1,7-naphthyridine
CID 91151447
2,8a-dihydro-1H-1,8-naphthyridine
CID 138598725
2-methyl-2,7a-dihydro-1H-benzimidazole
CID 139324229
1,2-Dihydropyrrolo[3,2-d][1,5]naphthyridin-7-amine
CID 141411572
2-ethyl-2,7a-dihydro-1H-benzimidazole
CID 144476583
4,4a-dihydro-3aH-pyrazolo[4,3-b]quinoline
CID 149253865
2-propan-2-yl-2,7a-dihydro-1H-benzimidazole
CID 177037157

Frequently Asked Questions

What is the IUPAC name of 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine?
The IUPAC name of 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine (CID 149253861) is 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine.
What is the SMILES notation for 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine?
The canonical SMILES for 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine is C1=CC2=CC3=NN=CC3NC2N=C1.
What is the InChIKey of 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine?
The InChIKey is ASLUDLGSDUKZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4/c1-2-6-4-7-8(5-11-13-7)12-9(6)10-3-1/h1-5,8-9,12H.
What are the key properties of 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine?
4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine has a molecular weight of 172.19 g/mol, XLogP of 0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine is sourced from PubChem (CID 149253861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).