2-[(6-cyanopyridazin-3-yl)amino]propanamide

C8H9N5O — CID 130676267

IUPAC2-[(6-cyanopyridazin-3-yl)amino]propanamide
SMILESCC(Nc1ccc(C#N)nn1)C(N)=O
InChIInChI=1S/C8H9N5O/c1-5(8(10)14)11-7-3-2-6(4-9)12-13-7/h2-3,5H,1H3,(H2,10,14)(H,11,13)
InChIKeyMNVCBUNFXKXKSV-UHFFFAOYSA-N
MW191.19 g/mol
LogP-0.37
Rot. Bonds3

About 2-[(6-cyanopyridazin-3-yl)amino]propanamide

2-[(6-cyanopyridazin-3-yl)amino]propanamide (PubChem CID 130676267) has the molecular formula C8H9N5O and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-[(6-cyanopyridazin-3-yl)amino]propanamide.

Molecular Properties

Compound Name2-[(6-cyanopyridazin-3-yl)amino]propanamide
PubChem CID130676267
Molecular FormulaC8H9N5O
Molecular Weight191.19 g/mol
Exact Mass191.08
IUPAC Name2-[(6-cyanopyridazin-3-yl)amino]propanamide
SMILESCC(Nc1ccc(C#N)nn1)C(N)=O
InChIInChI=1S/C8H9N5O/c1-5(8(10)14)11-7-3-2-6(4-9)12-13-7/h2-3,5H,1H3,(H2,10,14)(H,11,13)
InChIKeyMNVCBUNFXKXKSV-UHFFFAOYSA-N
XLogP-0.37
TPSA104.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(cyclopropylmethyl)-2-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]acetamide
CID 53617554
2-[Cyclopropyl(methyl)amino]-1-[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]ethanone
CID 56780019
N-(2-acetamidoethyl)-2-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]acetamide
CID 72144297
(3S)-3-[[6-(trifluoromethyl)pyridazin-3-yl]amino]piperidin-2-one
CID 97078638
tert-butyl N-[(2S)-4-[(6-cyanopyridazin-3-yl)amino]butan-2-yl]carbamate
CID 124614278
(6R)-4-(6-isopropylpyridazin-3-yl)-6-methylpiperazin-2-one
CID 132411377
4-methyl-2-[[[6-(trifluoromethyl)pyridazin-3-yl]amino]methyl]-1H-pyrimidin-6-one
CID 138018787
6-[4-[[2-[(2S)-2-cyano-4,4-difluoropyrrolidin-1-yl]-2-oxoethyl]amino]piperidin-1-yl]pyridazine-3-carbonitrile
CID 10150417
6-[4-[[2-(3,3-Difluoropyrrolidin-1-yl)-2-oxoethyl]amino]piperidin-1-yl]pyridazine-3-carbonitrile
CID 67000629
5-Fluoro-3-(methylamino)-1-(6-methylpyridazin-3-yl)pyridin-2-one
CID 137449421
5-Fluoro-1-(6-methylpyridazin-3-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 139390338
3-(Ethylamino)-5-fluoro-1-(6-methylpyridazin-3-yl)pyridin-2-one
CID 155007517

Frequently Asked Questions

What is the IUPAC name of 2-[(6-cyanopyridazin-3-yl)amino]propanamide?
The IUPAC name of 2-[(6-cyanopyridazin-3-yl)amino]propanamide (CID 130676267) is 2-[(6-cyanopyridazin-3-yl)amino]propanamide.
What is the SMILES notation for 2-[(6-cyanopyridazin-3-yl)amino]propanamide?
The canonical SMILES for 2-[(6-cyanopyridazin-3-yl)amino]propanamide is CC(Nc1ccc(C#N)nn1)C(N)=O.
What is the InChIKey of 2-[(6-cyanopyridazin-3-yl)amino]propanamide?
The InChIKey is MNVCBUNFXKXKSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O/c1-5(8(10)14)11-7-3-2-6(4-9)12-13-7/h2-3,5H,1H3,(H2,10,14)(H,11,13).
What are the key properties of 2-[(6-cyanopyridazin-3-yl)amino]propanamide?
2-[(6-cyanopyridazin-3-yl)amino]propanamide has a molecular weight of 191.19 g/mol, XLogP of -0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-cyanopyridazin-3-yl)amino]propanamide is sourced from PubChem (CID 130676267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).