6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide

C13H16N4O3 — CID 133490799

IUPAC6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NC(CCO)c2ccco2)nn1
InChIInChI=1S/C13H16N4O3/c1-14-13(19)10-4-5-12(17-16-10)15-9(6-7-18)11-3-2-8-20-11/h2-5,8-9,18H,6-7H2,1H3,(H,14,19)(H,15,17)
InChIKeyNTWNAXPRIQORQG-UHFFFAOYSA-N
MW276.30 g/mol
LogP0.96
Rot. Bonds6

About 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide

6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide (PubChem CID 133490799) has the molecular formula C13H16N4O3 and a molecular weight of 276.30 g/mol. Its IUPAC name is 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide
PubChem CID133490799
Molecular FormulaC13H16N4O3
Molecular Weight276.30 g/mol
Exact Mass276.12
IUPAC Name6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NC(CCO)c2ccco2)nn1
InChIInChI=1S/C13H16N4O3/c1-14-13(19)10-4-5-12(17-16-10)15-9(6-7-18)11-3-2-8-20-11/h2-5,8-9,18H,6-7H2,1H3,(H,14,19)(H,15,17)
InChIKeyNTWNAXPRIQORQG-UHFFFAOYSA-N
XLogP0.96
TPSA100.28 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 50.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide with MolForge

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Related Compounds

3-(furan-2-yl)-3-[(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)amino]propan-1-ol
CID 133493815
3-(furan-2-yl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]propan-1-ol
CID 133490778
6-[(1-cyclohexyl-3-hydroxypropyl)amino]-N-methylpyridazine-3-carboxamide
CID 133339706
3-[(3-ethyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)amino]-3-(furan-2-yl)propan-1-ol
CID 133490705
6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide
CID 133434733
3-(furan-2-yl)-3-[(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)amino]propan-1-ol
CID 133490838
N-methyl-6-(6-methylheptan-2-ylamino)pyridazine-3-carboxamide
CID 79207194
N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide
CID 133340260
3-anilino-3-(furan-2-yl)propan-1-ol
CID 83821736
3-(furan-2-yl)-3-(pyrido[2,3-b]pyrazin-6-ylamino)propan-1-ol
CID 133493774
N-methyl-6-(1-pyridin-2-ylethylamino)pyridazine-3-carboxamide
CID 79005908
3-(furan-2-yl)-3-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)amino]propan-1-ol
CID 133490704

Frequently Asked Questions

What is the IUPAC name of 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide?
The IUPAC name of 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide (CID 133490799) is 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide?
The canonical SMILES for 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide is CNC(=O)c1ccc(NC(CCO)c2ccco2)nn1.
What is the InChIKey of 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide?
The InChIKey is NTWNAXPRIQORQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O3/c1-14-13(19)10-4-5-12(17-16-10)15-9(6-7-18)11-3-2-8-20-11/h2-5,8-9,18H,6-7H2,1H3,(H,14,19)(H,15,17).
What are the key properties of 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide?
6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide has a molecular weight of 276.30 g/mol, XLogP of 0.96, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide is sourced from PubChem (CID 133490799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).