N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

C19H23N3O3 — CID 109399985

IUPACN-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESCN(CC1CCCC1O)C(=O)Cn1nc(-c2ccccc2)ccc1=O
InChIInChI=1S/C19H23N3O3/c1-21(12-15-8-5-9-17(15)23)19(25)13-22-18(24)11-10-16(20-22)14-6-3-2-4-7-14/h2-4,6-7,10-11,15,17,23H,5,8-9,12-13H2,1H3
InChIKeyVAJNUYADCAOYLL-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.53
Rot. Bonds5

About N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (PubChem CID 109399985) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
PubChem CID109399985
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESCN(CC1CCCC1O)C(=O)Cn1nc(-c2ccccc2)ccc1=O
InChIInChI=1S/C19H23N3O3/c1-21(12-15-8-5-9-17(15)23)19(25)13-22-18(24)11-10-16(20-22)14-6-3-2-4-7-14/h2-4,6-7,10-11,15,17,23H,5,8-9,12-13H2,1H3
InChIKeyVAJNUYADCAOYLL-UHFFFAOYSA-N
XLogP1.53
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-hydroxycyclohexyl)methyl]-N-methyl-2-(5-phenyltetrazol-2-yl)acetamide
CID 110003521
N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 126782676
2-[ethyl-[2-(6-oxo-3-phenylpyridazin-1-yl)acetyl]amino]acetic acid
CID 119205689
N-benzyl-N-methyl-2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)acetamide
CID 121052466
2-(6-oxo-3-phenylpyridazin-1-yl)-N-propan-2-ylacetamide
CID 5057313
N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 109400323
N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-phenylbenzamide
CID 109400318
N-cyclooctyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
CID 5053338
N-methyl-N-(2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-yl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
CID 126787740
2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-phenylpyridazin-3-one
CID 7659647
N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(5-phenyltetrazol-2-yl)propanamide
CID 109399686
2-(6-oxo-3-phenylpyridazin-1-yl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 119531551

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The IUPAC name of N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (CID 109399985) is N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.
What is the SMILES notation for N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The canonical SMILES for N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is CN(CC1CCCC1O)C(=O)Cn1nc(-c2ccccc2)ccc1=O.
What is the InChIKey of N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The InChIKey is VAJNUYADCAOYLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-21(12-15-8-5-9-17(15)23)19(25)13-22-18(24)11-10-16(20-22)14-6-3-2-4-7-14/h2-4,6-7,10-11,15,17,23H,5,8-9,12-13H2,1H3.
What are the key properties of N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide has a molecular weight of 341.41 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxycyclopentyl)methyl]-N-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is sourced from PubChem (CID 109399985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).