(8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine

C13H15ClN4 — CID 15631971

IUPAC(8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine
SMILESCN1CCc2nc3ccc(Cl)cc3c(NN)c2C1
InChIInChI=1S/C13H15ClN4/c1-18-5-4-12-10(7-18)13(17-15)9-6-8(14)2-3-11(9)16-12/h2-3,6H,4-5,7,15H2,1H3,(H,16,17)
InChIKeyXNLMJPNBNFZCRC-UHFFFAOYSA-N
MW262.74 g/mol
LogP2.16
Rot. Bonds1

About (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine

(8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine (PubChem CID 15631971) has the molecular formula C13H15ClN4 and a molecular weight of 262.74 g/mol. Its IUPAC name is (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine.

Molecular Properties

Compound Name(8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine
PubChem CID15631971
Molecular FormulaC13H15ClN4
Molecular Weight262.74 g/mol
Exact Mass262.10
IUPAC Name(8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine
SMILESCN1CCc2nc3ccc(Cl)cc3c(NN)c2C1
InChIInChI=1S/C13H15ClN4/c1-18-5-4-12-10(7-18)13(17-15)9-6-8(14)2-3-11(9)16-12/h2-3,6H,4-5,7,15H2,1H3,(H,16,17)
InChIKeyXNLMJPNBNFZCRC-UHFFFAOYSA-N
XLogP2.16
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine?
The IUPAC name of (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine (CID 15631971) is (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine.
What is the SMILES notation for (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine?
The canonical SMILES for (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine is CN1CCc2nc3ccc(Cl)cc3c(NN)c2C1.
What is the InChIKey of (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine?
The InChIKey is XNLMJPNBNFZCRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4/c1-18-5-4-12-10(7-18)13(17-15)9-6-8(14)2-3-11(9)16-12/h2-3,6H,4-5,7,15H2,1H3,(H,16,17).
What are the key properties of (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine?
(8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine has a molecular weight of 262.74 g/mol, XLogP of 2.16, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine is sourced from PubChem (CID 15631971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).