3-chloro-6-cyclopentylpyridazin-4-amine

C9H12ClN3 — CID 117127184

IUPAC3-chloro-6-cyclopentylpyridazin-4-amine
SMILESNc1cc(C2CCCC2)nnc1Cl
InChIInChI=1S/C9H12ClN3/c10-9-7(11)5-8(12-13-9)6-3-1-2-4-6/h5-6H,1-4H2,(H2,11,12)
InChIKeyFHRHPERHJSQIBO-UHFFFAOYSA-N
MW197.67 g/mol
LogP2.37
Rot. Bonds1

About 3-chloro-6-cyclopentylpyridazin-4-amine

3-chloro-6-cyclopentylpyridazin-4-amine (PubChem CID 117127184) has the molecular formula C9H12ClN3 and a molecular weight of 197.67 g/mol. Its IUPAC name is 3-chloro-6-cyclopentylpyridazin-4-amine.

Molecular Properties

Compound Name3-chloro-6-cyclopentylpyridazin-4-amine
PubChem CID117127184
Molecular FormulaC9H12ClN3
Molecular Weight197.67 g/mol
Exact Mass197.07
IUPAC Name3-chloro-6-cyclopentylpyridazin-4-amine
SMILESNc1cc(C2CCCC2)nnc1Cl
InChIInChI=1S/C9H12ClN3/c10-9-7(11)5-8(12-13-9)6-3-1-2-4-6/h5-6H,1-4H2,(H2,11,12)
InChIKeyFHRHPERHJSQIBO-UHFFFAOYSA-N
XLogP2.37
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.67
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Chloro-6-cyclohexylpyridazine
CID 13735308
6-Cyclopentylpyridazine-3,4-diamine
CID 117107200
6-(5-Chloro-2-fluorophenyl)-3-cyclopropylpyridazin-4-amine
CID 168072375
6-(5-Chloro-2-fluorophenyl)-3-methylpyridazin-4-amine
CID 168072377
3-Chloro-6-[[3-(trifluoromethyl)phenyl]methyl]pyridazin-4-amine
CID 117106494
3-Chloro-6-[(3-fluorophenyl)methyl]pyridazin-4-amine
CID 117106544
3-Chloro-6-[[2-(trifluoromethyl)phenyl]methyl]pyridazin-4-amine
CID 117106637
3-Chloro-6-[(2-fluorophenyl)methyl]pyridazin-4-amine
CID 117106667
3-Chloro-6-[[4-(trifluoromethyl)phenyl]methyl]pyridazin-4-amine
CID 117106755
3-Chloro-6-[(4-fluorophenyl)methyl]pyridazin-4-amine
CID 117106791
3-Chloro-6-[3-(trifluoromethyl)phenyl]pyridazin-4-amine
CID 117127131
3-Chloro-6-(3-fluorophenyl)pyridazin-4-amine
CID 117127138

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-cyclopentylpyridazin-4-amine?
The IUPAC name of 3-chloro-6-cyclopentylpyridazin-4-amine (CID 117127184) is 3-chloro-6-cyclopentylpyridazin-4-amine.
What is the SMILES notation for 3-chloro-6-cyclopentylpyridazin-4-amine?
The canonical SMILES for 3-chloro-6-cyclopentylpyridazin-4-amine is Nc1cc(C2CCCC2)nnc1Cl.
What is the InChIKey of 3-chloro-6-cyclopentylpyridazin-4-amine?
The InChIKey is FHRHPERHJSQIBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClN3/c10-9-7(11)5-8(12-13-9)6-3-1-2-4-6/h5-6H,1-4H2,(H2,11,12).
What are the key properties of 3-chloro-6-cyclopentylpyridazin-4-amine?
3-chloro-6-cyclopentylpyridazin-4-amine has a molecular weight of 197.67 g/mol, XLogP of 2.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-cyclopentylpyridazin-4-amine is sourced from PubChem (CID 117127184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).