N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide

C18H18N4O3 — CID 126938795

IUPACN-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide
SMILESCc1ccc(=O)n(C2COCC2NC(=O)c2cccc3[nH]ccc23)n1
InChIInChI=1S/C18H18N4O3/c1-11-5-6-17(23)22(21-11)16-10-25-9-15(16)20-18(24)13-3-2-4-14-12(13)7-8-19-14/h2-8,15-16,19H,9-10H2,1H3,(H,20,24)
InChIKeyGLZIXGJHXOFAHW-UHFFFAOYSA-N
MW338.37 g/mol
LogP1.40
Rot. Bonds3

About N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide

N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide (PubChem CID 126938795) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide
PubChem CID126938795
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC NameN-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide
SMILESCc1ccc(=O)n(C2COCC2NC(=O)c2cccc3[nH]ccc23)n1
InChIInChI=1S/C18H18N4O3/c1-11-5-6-17(23)22(21-11)16-10-25-9-15(16)20-18(24)13-3-2-4-14-12(13)7-8-19-14/h2-8,15-16,19H,9-10H2,1H3,(H,20,24)
InChIKeyGLZIXGJHXOFAHW-UHFFFAOYSA-N
XLogP1.40
TPSA89.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 126938910
5-bromo-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]furan-2-carboxamide
CID 126938757
5-bromo-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]thiophene-2-carboxamide
CID 126938917
2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 126938763
N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1-benzofuran-2-carboxamide
CID 126938758
N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]indolizine-2-carboxamide
CID 126938783
N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide
CID 126938792
N-(2-hydroxycyclohexyl)-1H-indole-4-carboxamide
CID 62366462
N-(2-ethylcyclopropyl)-1H-indole-4-carboxamide
CID 103721300
N-[4-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)oxolan-3-yl]-1H-indole-5-carboxamide
CID 126940248
6-[[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile
CID 126938812
N-[4-(3-methyl-6-oxopyridazin-1-yl)cyclohexyl]-2-oxo-1H-pyridine-3-carboxamide
CID 126934601

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide?
The IUPAC name of N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide (CID 126938795) is N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide.
What is the SMILES notation for N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide?
The canonical SMILES for N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide is Cc1ccc(=O)n(C2COCC2NC(=O)c2cccc3[nH]ccc23)n1.
What is the InChIKey of N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide?
The InChIKey is GLZIXGJHXOFAHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c1-11-5-6-17(23)22(21-11)16-10-25-9-15(16)20-18(24)13-3-2-4-14-12(13)7-8-19-14/h2-8,15-16,19H,9-10H2,1H3,(H,20,24).
What are the key properties of N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide?
N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide has a molecular weight of 338.37 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide is sourced from PubChem (CID 126938795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).