N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide

C19H25N5O4 — CID 91911769

IUPACN-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide
SMILESCCn1ncc(N2CCC(NC(=O)c3ccc(OC)nc3OC)CC2)cc1=O
InChIInChI=1S/C19H25N5O4/c1-4-24-17(25)11-14(12-20-24)23-9-7-13(8-10-23)21-18(26)15-5-6-16(27-2)22-19(15)28-3/h5-6,11-13H,4,7-10H2,1-3H3,(H,21,26)
InChIKeyRVWXTCNGEUEPTB-UHFFFAOYSA-N
MW387.44 g/mol
LogP1.07
Rot. Bonds6

About N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide

N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide (PubChem CID 91911769) has the molecular formula C19H25N5O4 and a molecular weight of 387.44 g/mol. Its IUPAC name is N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide
PubChem CID91911769
Molecular FormulaC19H25N5O4
Molecular Weight387.44 g/mol
Exact Mass387.19
IUPAC NameN-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide
SMILESCCn1ncc(N2CCC(NC(=O)c3ccc(OC)nc3OC)CC2)cc1=O
InChIInChI=1S/C19H25N5O4/c1-4-24-17(25)11-14(12-20-24)23-9-7-13(8-10-23)21-18(26)15-5-6-16(27-2)22-19(15)28-3/h5-6,11-13H,4,7-10H2,1-3H3,(H,21,26)
InChIKeyRVWXTCNGEUEPTB-UHFFFAOYSA-N
XLogP1.07
TPSA98.58 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-4-methoxy-2-methylbenzamide
CID 91924053
N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-3-fluoro-4-methoxybenzamide
CID 91911783
2-ethoxy-N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]acetamide
CID 91924055
N-[1-[1-(cyclopropylmethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]-2-methoxybenzamide
CID 91924069
N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2-(4-methylphenyl)acetamide
CID 91911776
4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide
CID 91924018
N-[1-[1-(cyclopropylmethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]-3-methoxybenzamide
CID 91911835
N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]-4-propan-2-ylbenzamide
CID 91924080
2,6-dimethoxy-N-(2-methyl-3-oxo-5,6,7,8-tetrahydrocinnolin-6-yl)pyridine-3-carboxamide
CID 91632677
2,6-dimethoxy-N-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]pyridine-3-carboxamide
CID 99976530
2,6-dimethoxy-N-[1-[(1R,2R,9S)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]tridecane-11-carbonyl]piperidin-4-yl]pyridine-3-carboxamide
CID 110195522
N-[1-(1-benzyl-6-oxopyridazin-4-yl)piperidin-4-yl]-3-methylthiophene-2-carboxamide
CID 91911806

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide?
The IUPAC name of N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide (CID 91911769) is N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide.
What is the SMILES notation for N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide?
The canonical SMILES for N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide is CCn1ncc(N2CCC(NC(=O)c3ccc(OC)nc3OC)CC2)cc1=O.
What is the InChIKey of N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide?
The InChIKey is RVWXTCNGEUEPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O4/c1-4-24-17(25)11-14(12-20-24)23-9-7-13(8-10-23)21-18(26)15-5-6-16(27-2)22-19(15)28-3/h5-6,11-13H,4,7-10H2,1-3H3,(H,21,26).
What are the key properties of N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide?
N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide has a molecular weight of 387.44 g/mol, XLogP of 1.07, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide is sourced from PubChem (CID 91911769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).