N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide

C14H22N6O2 — CID 121028153

IUPACN-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide
SMILESCN1CCN(NC(=O)c2ccc(N3CCOCC3)nn2)CC1
InChIInChI=1S/C14H22N6O2/c1-18-4-6-20(7-5-18)17-14(21)12-2-3-13(16-15-12)19-8-10-22-11-9-19/h2-3H,4-11H2,1H3,(H,17,21)
InChIKeyIYYYWGOBEILPND-UHFFFAOYSA-N
MW306.37 g/mol
LogP-0.79
Rot. Bonds3

About N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide

N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide (PubChem CID 121028153) has the molecular formula C14H22N6O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide
PubChem CID121028153
Molecular FormulaC14H22N6O2
Molecular Weight306.37 g/mol
Exact Mass306.18
IUPAC NameN-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide
SMILESCN1CCN(NC(=O)c2ccc(N3CCOCC3)nn2)CC1
InChIInChI=1S/C14H22N6O2/c1-18-4-6-20(7-5-18)17-14(21)12-2-3-13(16-15-12)19-8-10-22-11-9-19/h2-3H,4-11H2,1H3,(H,17,21)
InChIKeyIYYYWGOBEILPND-UHFFFAOYSA-N
XLogP-0.79
TPSA73.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-morpholin-4-yl-N-propan-2-ylpyridazine-3-carboxamide
CID 109109608
methyl 6-morpholin-4-ylpyridazine-3-carboxylate
CID 121206139
6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide
CID 109114518
N-(4-chlorophenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114542
6-(1,4-oxazepan-4-yl)pyridazine-3-carboxylic acid
CID 62973875
N-(2,6-difluorophenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114612
N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 121028121
N-[4-(diethylamino)phenyl]-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114572
N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114560
N-(3,5-dichlorophenyl)-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109116280
6-morpholin-4-yl-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109114472
N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114455

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The IUPAC name of N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide (CID 121028153) is N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The canonical SMILES for N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide is CN1CCN(NC(=O)c2ccc(N3CCOCC3)nn2)CC1.
What is the InChIKey of N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The InChIKey is IYYYWGOBEILPND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O2/c1-18-4-6-20(7-5-18)17-14(21)12-2-3-13(16-15-12)19-8-10-22-11-9-19/h2-3H,4-11H2,1H3,(H,17,21).
What are the key properties of N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide?
N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide has a molecular weight of 306.37 g/mol, XLogP of -0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperazin-1-yl)-6-morpholin-4-ylpyridazine-3-carboxamide is sourced from PubChem (CID 121028153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).