[6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol

C10H14ClN3O — CID 165176193

IUPAC[6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol
SMILESOCc1nnc(Cl)cc1NC1CCCC1
InChIInChI=1S/C10H14ClN3O/c11-10-5-8(9(6-15)13-14-10)12-7-3-1-2-4-7/h5,7,15H,1-4,6H2,(H,12,14)
InChIKeyKOIBQIMWYPQKIS-UHFFFAOYSA-N
MW227.69 g/mol
LogP1.98
Rot. Bonds3

About [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol

[6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol (PubChem CID 165176193) has the molecular formula C10H14ClN3O and a molecular weight of 227.69 g/mol. Its IUPAC name is [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol.

Molecular Properties

Compound Name[6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol
PubChem CID165176193
Molecular FormulaC10H14ClN3O
Molecular Weight227.69 g/mol
Exact Mass227.08
IUPAC Name[6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol
SMILESOCc1nnc(Cl)cc1NC1CCCC1
InChIInChI=1S/C10H14ClN3O/c11-10-5-8(9(6-15)13-14-10)12-7-3-1-2-4-7/h5,7,15H,1-4,6H2,(H,12,14)
InChIKeyKOIBQIMWYPQKIS-UHFFFAOYSA-N
XLogP1.98
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol?
The IUPAC name of [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol (CID 165176193) is [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol.
What is the SMILES notation for [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol?
The canonical SMILES for [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol is OCc1nnc(Cl)cc1NC1CCCC1.
What is the InChIKey of [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol?
The InChIKey is KOIBQIMWYPQKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c11-10-5-8(9(6-15)13-14-10)12-7-3-1-2-4-7/h5,7,15H,1-4,6H2,(H,12,14).
What are the key properties of [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol?
[6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol has a molecular weight of 227.69 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol is sourced from PubChem (CID 165176193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).