N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide

C15H22N4O — CID 109112077

IUPACN-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(NC2CCCC2)nn1
InChIInChI=1S/C15H22N4O/c20-15(17-12-7-3-4-8-12)13-9-10-14(19-18-13)16-11-5-1-2-6-11/h9-12H,1-8H2,(H,16,19)(H,17,20)
InChIKeyQMHQFEXRHOGWLE-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.50
Rot. Bonds4

About N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide

N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide (PubChem CID 109112077) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide
PubChem CID109112077
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(NC2CCCC2)nn1
InChIInChI=1S/C15H22N4O/c20-15(17-12-7-3-4-8-12)13-9-10-14(19-18-13)16-11-5-1-2-6-11/h9-12H,1-8H2,(H,16,19)(H,17,20)
InChIKeyQMHQFEXRHOGWLE-UHFFFAOYSA-N
XLogP2.50
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide?
The IUPAC name of N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide (CID 109112077) is N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide is O=C(NC1CCCC1)c1ccc(NC2CCCC2)nn1.
What is the InChIKey of N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide?
The InChIKey is QMHQFEXRHOGWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c20-15(17-12-7-3-4-8-12)13-9-10-14(19-18-13)16-11-5-1-2-6-11/h9-12H,1-8H2,(H,16,19)(H,17,20).
What are the key properties of N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide?
N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide has a molecular weight of 274.37 g/mol, XLogP of 2.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 109112077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).