6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide

C10H16N4O2 — CID 133434733

IUPAC6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide
SMILESCC[C@H](CO)Nc1ccc(C(=O)NC)nn1
InChIInChI=1S/C10H16N4O2/c1-3-7(6-15)12-9-5-4-8(13-14-9)10(16)11-2/h4-5,7,15H,3,6H2,1-2H3,(H,11,16)(H,12,14)/t7-/m1/s1
InChIKeyAGVVVPSPJJRVGT-SSDOTTSWSA-N
MW224.26 g/mol
LogP0.02
Rot. Bonds5

About 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide

6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide (PubChem CID 133434733) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide
PubChem CID133434733
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide
SMILESCC[C@H](CO)Nc1ccc(C(=O)NC)nn1
InChIInChI=1S/C10H16N4O2/c1-3-7(6-15)12-9-5-4-8(13-14-9)10(16)11-2/h4-5,7,15H,3,6H2,1-2H3,(H,11,16)(H,12,14)/t7-/m1/s1
InChIKeyAGVVVPSPJJRVGT-SSDOTTSWSA-N
XLogP0.02
TPSA87.14 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-(1-aminohexan-2-ylamino)-N-methylpyridazine-3-carboxamide
CID 80697257
N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide
CID 133340260
N-methyl-6-(6-methylheptan-2-ylamino)pyridazine-3-carboxamide
CID 79207194
6-[(1-methoxy-3-methylbutan-2-yl)amino]-N-methylpyridazine-3-carboxamide
CID 79214306
6-chloro-N-(1-hydroxybutan-2-yl)pyridazine-3-carboxamide
CID 61041980
6-[(5-hydroxy-4-methylpentyl)amino]-N-methylpyridazine-3-carboxamide
CID 103858516
6-[[1-(furan-2-yl)-3-hydroxypropyl]amino]-N-methylpyridazine-3-carboxamide
CID 133490799
6-[(1-cyclohexyl-3-hydroxypropyl)amino]-N-methylpyridazine-3-carboxamide
CID 133339706
6-(4-hydroxybutylamino)-N-methylpyridazine-3-carboxamide
CID 106842680
3-cyclopropyl-2-[[6-(methylcarbamoyl)pyridazin-3-yl]amino]propanoic acid
CID 112735032
6-[[4-(dimethylamino)-3,3-dimethylbutan-2-yl]amino]-N-methylpyridazine-3-carboxamide
CID 133349282
N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
CID 106158242

Frequently Asked Questions

What is the IUPAC name of 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide?
The IUPAC name of 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide (CID 133434733) is 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide?
The canonical SMILES for 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide is CC[C@H](CO)Nc1ccc(C(=O)NC)nn1.
What is the InChIKey of 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide?
The InChIKey is AGVVVPSPJJRVGT-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-3-7(6-15)12-9-5-4-8(13-14-9)10(16)11-2/h4-5,7,15H,3,6H2,1-2H3,(H,11,16)(H,12,14)/t7-/m1/s1.
What are the key properties of 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide?
6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.02, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide is sourced from PubChem (CID 133434733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).