7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one

C10H8ClN3O — CID 140975892

IUPAC7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one
SMILESO=c1[nH]c2cc(Cl)ccc2c2c1CNN2
InChIInChI=1S/C10H8ClN3O/c11-5-1-2-6-8(3-5)13-10(15)7-4-12-14-9(6)7/h1-3,12,14H,4H2,(H,13,15)
InChIKeyNHSIOFWBCXBMLO-UHFFFAOYSA-N
MW221.65 g/mol
LogP1.61
Rot. Bonds

About 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one

7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one (PubChem CID 140975892) has the molecular formula C10H8ClN3O and a molecular weight of 221.65 g/mol. Its IUPAC name is 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

Compound Name7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one
PubChem CID140975892
Molecular FormulaC10H8ClN3O
Molecular Weight221.65 g/mol
Exact Mass221.04
IUPAC Name7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one
SMILESO=c1[nH]c2cc(Cl)ccc2c2c1CNN2
InChIInChI=1S/C10H8ClN3O/c11-5-1-2-6-8(3-5)13-10(15)7-4-12-14-9(6)7/h1-3,12,14H,4H2,(H,13,15)
InChIKeyNHSIOFWBCXBMLO-UHFFFAOYSA-N
XLogP1.61
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.65
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one?
The IUPAC name of 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one (CID 140975892) is 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one.
What is the SMILES notation for 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one?
The canonical SMILES for 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one is O=c1[nH]c2cc(Cl)ccc2c2c1CNN2.
What is the InChIKey of 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one?
The InChIKey is NHSIOFWBCXBMLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3O/c11-5-1-2-6-8(3-5)13-10(15)7-4-12-14-9(6)7/h1-3,12,14H,4H2,(H,13,15).
What are the key properties of 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one?
7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one has a molecular weight of 221.65 g/mol, XLogP of 1.61, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1,2,3,5-tetrahydropyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 140975892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).