3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol

C10H18N4O — CID 106174456

IUPAC3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol
SMILESCCC(C)(CCO)Nc1ccc(N)nn1
InChIInChI=1S/C10H18N4O/c1-3-10(2,6-7-15)12-9-5-4-8(11)13-14-9/h4-5,15H,3,6-7H2,1-2H3,(H2,11,13)(H,12,14)
InChIKeyJVBMZYIFACQXCG-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.02
Rot. Bonds5

About 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol

3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol (PubChem CID 106174456) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol.

Molecular Properties

Compound Name3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol
PubChem CID106174456
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol
SMILESCCC(C)(CCO)Nc1ccc(N)nn1
InChIInChI=1S/C10H18N4O/c1-3-10(2,6-7-15)12-9-5-4-8(11)13-14-9/h4-5,15H,3,6-7H2,1-2H3,(H2,11,13)(H,12,14)
InChIKeyJVBMZYIFACQXCG-UHFFFAOYSA-N
XLogP1.02
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(1-hydroxy-3-methylpentan-3-yl)amino]pyridazine-3-carbonitrile
CID 133420472
3-[(6-amino-2-ethylpyrimidin-4-yl)amino]-3-methylpentan-1-ol
CID 106179255
3-[(5-fluoro-2-pyridinyl)amino]-3-methylpentan-1-ol
CID 106171523
3-[(3-amino-4-pyridinyl)amino]-3-methylpentan-1-ol
CID 106166860
3-[(6-methoxy-2-pyridinyl)amino]-3-methylpentan-1-ol
CID 106171463
3-methyl-3-[[6-(trifluoromethyl)-2-pyridinyl]amino]pentan-1-ol
CID 106171147
3-methyl-3-[(5-nitro-2-pyridinyl)amino]pentan-1-ol
CID 113258140
3-(3-aminoanilino)-3-methylpentan-1-ol
CID 106167043
3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol
CID 106179542
3-methyl-3-[[6-(methylamino)-2-methylsulfanylpyrimidin-4-yl]amino]pentan-1-ol
CID 106179091
3-[(6-fluoropyrimidin-4-yl)amino]-3-methylpentan-1-ol
CID 106178744
3-[(6-bromopyrimidin-4-yl)amino]-3-methylpentan-1-ol
CID 106178733

Frequently Asked Questions

What is the IUPAC name of 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol?
The IUPAC name of 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol (CID 106174456) is 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol.
What is the SMILES notation for 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol?
The canonical SMILES for 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol is CCC(C)(CCO)Nc1ccc(N)nn1.
What is the InChIKey of 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol?
The InChIKey is JVBMZYIFACQXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-3-10(2,6-7-15)12-9-5-4-8(11)13-14-9/h4-5,15H,3,6-7H2,1-2H3,(H2,11,13)(H,12,14).
What are the key properties of 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol?
3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol has a molecular weight of 210.28 g/mol, XLogP of 1.02, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol is sourced from PubChem (CID 106174456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).