1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide

C15H18N4O3 — CID 94015301

IUPAC1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide
SMILESCOCCn1nc(C(=O)N[C@H](C)c2cccnc2)ccc1=O
InChIInChI=1S/C15H18N4O3/c1-11(12-4-3-7-16-10-12)17-15(21)13-5-6-14(20)19(18-13)8-9-22-2/h3-7,10-11H,8-9H2,1-2H3,(H,17,21)/t11-/m1/s1
InChIKeyZOAAZJIJHVQQIZ-LLVKDONJSA-N
MW302.33 g/mol
LogP0.78
Rot. Bonds6

About 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide

1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide (PubChem CID 94015301) has the molecular formula C15H18N4O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide
PubChem CID94015301
Molecular FormulaC15H18N4O3
Molecular Weight302.33 g/mol
Exact Mass302.14
IUPAC Name1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide
SMILESCOCCn1nc(C(=O)N[C@H](C)c2cccnc2)ccc1=O
InChIInChI=1S/C15H18N4O3/c1-11(12-4-3-7-16-10-12)17-15(21)13-5-6-14(20)19(18-13)8-9-22-2/h3-7,10-11H,8-9H2,1-2H3,(H,17,21)/t11-/m1/s1
InChIKeyZOAAZJIJHVQQIZ-LLVKDONJSA-N
XLogP0.78
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2R)-1-hydroxypropan-2-yl]-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 79027672
N-[1-(4-fluorophenyl)ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide
CID 43033670
N-[1-(3-chlorophenyl)ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide
CID 24505534
N-[(2R)-2-hydroxypropyl]-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 83031566
N-(1-hydroxy-4-methylpentan-2-yl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 61247357
1-(2-methoxyethyl)-6-oxo-N-(4-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 35019256
(2S)-2-[[1-(2-methoxyethyl)-6-oxopyridazine-3-carbonyl]amino]-4-methylpentanoic acid
CID 119362071
N-(4-hydroxy-1-methoxybutan-2-yl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 103799623
1-[1-(2-methoxyethyl)pyrazol-4-yl]-3-[(1R)-1-pyridin-3-ylethyl]urea
CID 95130177
1-[1-(2-methoxyethyl)pyrazol-4-yl]-3-[(1S)-1-pyridin-3-ylethyl]urea
CID 95130176
methyl N-[(1R)-1-pyridin-3-ylethyl]carbamate
CID 130621848
1-(2-methoxyethyl)-6-oxo-N-(2-phenoxyethyl)pyridazine-3-carboxamide
CID 32934057

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide (CID 94015301) is 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide is COCCn1nc(C(=O)N[C@H](C)c2cccnc2)ccc1=O.
What is the InChIKey of 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide?
The InChIKey is ZOAAZJIJHVQQIZ-LLVKDONJSA-N. The full InChI is InChI=1S/C15H18N4O3/c1-11(12-4-3-7-16-10-12)17-15(21)13-5-6-14(20)19(18-13)8-9-22-2/h3-7,10-11H,8-9H2,1-2H3,(H,17,21)/t11-/m1/s1.
What are the key properties of 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide?
1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 0.78, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-6-oxo-N-[(1R)-1-pyridin-3-ylethyl]pyridazine-3-carboxamide is sourced from PubChem (CID 94015301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).