N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide

C19H24N4O2 — CID 121101080

IUPACN-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide
SMILESCC1CCCCC1NC(=O)C(C)n1nc(-c2ccncc2)ccc1=O
InChIInChI=1S/C19H24N4O2/c1-13-5-3-4-6-16(13)21-19(25)14(2)23-18(24)8-7-17(22-23)15-9-11-20-12-10-15/h7-14,16H,3-6H2,1-2H3,(H,21,25)
InChIKeyGHHIVANQXIPGPK-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.56
Rot. Bonds4

About N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide

N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide (PubChem CID 121101080) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide.

Molecular Properties

Compound NameN-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide
PubChem CID121101080
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide
SMILESCC1CCCCC1NC(=O)C(C)n1nc(-c2ccncc2)ccc1=O
InChIInChI=1S/C19H24N4O2/c1-13-5-3-4-6-16(13)21-19(25)14(2)23-18(24)8-7-17(22-23)15-9-11-20-12-10-15/h7-14,16H,3-6H2,1-2H3,(H,21,25)
InChIKeyGHHIVANQXIPGPK-UHFFFAOYSA-N
XLogP2.56
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide?
The IUPAC name of N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide (CID 121101080) is N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide.
What is the SMILES notation for N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide?
The canonical SMILES for N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide is CC1CCCCC1NC(=O)C(C)n1nc(-c2ccncc2)ccc1=O.
What is the InChIKey of N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide?
The InChIKey is GHHIVANQXIPGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-13-5-3-4-6-16(13)21-19(25)14(2)23-18(24)8-7-17(22-23)15-9-11-20-12-10-15/h7-14,16H,3-6H2,1-2H3,(H,21,25).
What are the key properties of N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide?
N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide has a molecular weight of 340.43 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide is sourced from PubChem (CID 121101080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).