6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide

C15H24N4O — CID 109111349

IUPAC6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide
SMILESCCC(C)Nc1ccc(C(=O)NC2CCCCC2)nn1
InChIInChI=1S/C15H24N4O/c1-3-11(2)16-14-10-9-13(18-19-14)15(20)17-12-7-5-4-6-8-12/h9-12H,3-8H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyBGDHVUIOWHDLSI-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.75
Rot. Bonds5

About 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide

6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide (PubChem CID 109111349) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide
PubChem CID109111349
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide
SMILESCCC(C)Nc1ccc(C(=O)NC2CCCCC2)nn1
InChIInChI=1S/C15H24N4O/c1-3-11(2)16-14-10-9-13(18-19-14)15(20)17-12-7-5-4-6-8-12/h9-12H,3-8H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyBGDHVUIOWHDLSI-UHFFFAOYSA-N
XLogP2.75
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-6-(ethylamino)pyridazine-3-carboxamide
CID 55042572
N-butan-2-yl-6-(cyclohexylamino)pyridazine-3-carboxamide
CID 109111540
N-cyclohexyl-6-(pentylamino)pyridazine-3-carboxamide
CID 109113045
N-cyclohexyl-6-(cyclohexylamino)pyridazine-3-carboxamide
CID 109112809
6-(cycloheptylamino)-N-cyclopropylpyridazine-3-carboxamide
CID 109110063
N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide
CID 109112077
4-(butan-2-ylamino)-N-cyclohexylpyridine-2-carboxamide
CID 109203427
N-[6-(butan-2-ylamino)pyridazin-3-yl]cyclohexanecarboxamide
CID 113038564
N-cyclohexyl-6-(2-methoxyethylamino)pyridazine-3-carboxamide
CID 109112980
[6-(butan-2-ylamino)pyridazin-3-yl]-piperidin-1-ylmethanone
CID 109111348
5-(butan-2-ylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179836
N-(4-acetamidophenyl)-6-(butan-2-ylamino)pyridazine-3-carboxamide
CID 109111487

Frequently Asked Questions

What is the IUPAC name of 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide?
The IUPAC name of 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide (CID 109111349) is 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide.
What is the SMILES notation for 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide?
The canonical SMILES for 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide is CCC(C)Nc1ccc(C(=O)NC2CCCCC2)nn1.
What is the InChIKey of 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide?
The InChIKey is BGDHVUIOWHDLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-3-11(2)16-14-10-9-13(18-19-14)15(20)17-12-7-5-4-6-8-12/h9-12H,3-8H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide?
6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide is sourced from PubChem (CID 109111349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).