N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide

C16H19N3O3 — CID 7658271

IUPACN-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
SMILESO=C(Cn1nc(-c2ccco2)ccc1=O)NC1CCCCC1
InChIInChI=1S/C16H19N3O3/c20-15(17-12-5-2-1-3-6-12)11-19-16(21)9-8-13(18-19)14-7-4-10-22-14/h4,7-10,12H,1-3,5-6,11H2,(H,17,20)
InChIKeyPLVLZWFYEJCQRC-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.95
Rot. Bonds4

About N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide

N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide (PubChem CID 7658271) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
PubChem CID7658271
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
SMILESO=C(Cn1nc(-c2ccco2)ccc1=O)NC1CCCCC1
InChIInChI=1S/C16H19N3O3/c20-15(17-12-5-2-1-3-6-12)11-19-16(21)9-8-13(18-19)14-7-4-10-22-14/h4,7-10,12H,1-3,5-6,11H2,(H,17,20)
InChIKeyPLVLZWFYEJCQRC-UHFFFAOYSA-N
XLogP1.95
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Fluoro-N-({N'-[(1E)-1-(furan-2-YL)ethylidene]hydrazinecarbonyl}methyl)benzamide
CID 9611294
3-Fluoro-N-({N'-[(1E)-1-(furan-2-YL)ethylidene]hydrazinecarbonyl}methyl)benzamide
CID 9677979
N-(1-{[2-(2-furylmethylene)hydrazino]carbonyl}-3-methylbutyl)benzamide
CID 9602528
3-Furan-2-yl-N-(1-phenyl-propylidene-hydrazinocarbonylmethyl)-acrylamide
CID 6375344
N-[1-Furan-2-yl-eth-(Z)-ylidene-hydrazinocarbonylmethyl]-2-phenyl-acetamide
CID 6392314
(E)-N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]-3-phenylprop-2-enamide
CID 6371505
(E)-N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]-3-(2-methoxyphenyl)prop-2-enamide
CID 5751740
1-cyclohexyl-3-[(E)-1-(furan-2-yl)ethylideneamino]urea
CID 6003887
(E)-4-fluoro-N-(2-(2-(1-(furan-2-yl)ethylidene)hydrazinyl)-2-oxoethyl)benzamide
CID 6035769
N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]-2,2-diphenylacetamide
CID 6368130
N'-[(E)-furan-2-ylmethylideneamino]-N-propan-2-yloxamide
CID 5335357
(2E)-N-(2-{(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)-3-(4-methoxyphenyl)prop-2-enamide (non-preferred name)
CID 5903448

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide?
The IUPAC name of N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide (CID 7658271) is N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide?
The canonical SMILES for N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide is O=C(Cn1nc(-c2ccco2)ccc1=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide?
The InChIKey is PLVLZWFYEJCQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c20-15(17-12-5-2-1-3-6-12)11-19-16(21)9-8-13(18-19)14-7-4-10-22-14/h4,7-10,12H,1-3,5-6,11H2,(H,17,20).
What are the key properties of N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide?
N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide has a molecular weight of 301.35 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide is sourced from PubChem (CID 7658271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).