N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide

C15H18N6O3 — CID 121028040

IUPACN-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide
SMILESCn1c(NC(=O)c2ccc(N3CCCCC3)nn2)cc(=O)[nH]c1=O
InChIInChI=1S/C15H18N6O3/c1-20-12(9-13(22)17-15(20)24)16-14(23)10-5-6-11(19-18-10)21-7-3-2-4-8-21/h5-6,9H,2-4,7-8H2,1H3,(H,16,23)(H,17,22,24)
InChIKeyFVESIXUVCPRINJ-UHFFFAOYSA-N
MW330.35 g/mol
LogP0.11
Rot. Bonds3

About N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide

N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide (PubChem CID 121028040) has the molecular formula C15H18N6O3 and a molecular weight of 330.35 g/mol. Its IUPAC name is N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide
PubChem CID121028040
Molecular FormulaC15H18N6O3
Molecular Weight330.35 g/mol
Exact Mass330.14
IUPAC NameN-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide
SMILESCn1c(NC(=O)c2ccc(N3CCCCC3)nn2)cc(=O)[nH]c1=O
InChIInChI=1S/C15H18N6O3/c1-20-12(9-13(22)17-15(20)24)16-14(23)10-5-6-11(19-18-10)21-7-3-2-4-8-21/h5-6,9H,2-4,7-8H2,1H3,(H,16,23)(H,17,22,24)
InChIKeyFVESIXUVCPRINJ-UHFFFAOYSA-N
XLogP0.11
TPSA112.98 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-piperidin-1-yl-N-(3,4,5-trimethoxyphenyl)pyridazine-3-carboxamide
CID 109112601
6-(azepan-1-yl)-N-(2,6-dimethylphenyl)pyridazine-3-carboxamide
CID 109126362
6-(azepan-1-yl)-N-(3-methylphenyl)pyridazine-3-carboxamide
CID 109126354
N-(2-tert-butyl-5-methylpyrazol-3-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 56824383
N-(5-chloro-2-methylphenyl)-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112555
6-(azepan-1-yl)-N-(4-chloro-2-methylphenyl)pyridazine-3-carboxamide
CID 109126380
N-(3,5-dimethoxyphenyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 121027738
6-(azepan-1-yl)-N-(4-ethylphenyl)pyridazine-3-carboxamide
CID 109126365
N-(1H-benzimidazol-2-yl)-6-piperidin-1-ylpyridazine-3-carboxamide
CID 121027952
N-(3-fluoro-4-methylphenyl)-6-piperidin-1-ylpyridazine-3-carboxamide
CID 71778546
6-(azepan-1-yl)-N-(4-bromo-2-methylphenyl)pyridazine-3-carboxamide
CID 109126420
N-(2-methylphenyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 109111795

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide?
The IUPAC name of N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide (CID 121028040) is N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide?
The canonical SMILES for N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide is Cn1c(NC(=O)c2ccc(N3CCCCC3)nn2)cc(=O)[nH]c1=O.
What is the InChIKey of N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide?
The InChIKey is FVESIXUVCPRINJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O3/c1-20-12(9-13(22)17-15(20)24)16-14(23)10-5-6-11(19-18-10)21-7-3-2-4-8-21/h5-6,9H,2-4,7-8H2,1H3,(H,16,23)(H,17,22,24).
What are the key properties of N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide?
N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide has a molecular weight of 330.35 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2,6-dioxopyrimidin-4-yl)-6-piperidin-1-ylpyridazine-3-carboxamide is sourced from PubChem (CID 121028040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).