[1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol

C10H15N3O — CID 115455152

IUPAC[1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol
SMILESCc1ccc(NCC2(CO)CC2)nn1
InChIInChI=1S/C10H15N3O/c1-8-2-3-9(13-12-8)11-6-10(7-14)4-5-10/h2-3,14H,4-7H2,1H3,(H,11,13)
InChIKeyCYJLITFDUKXNBQ-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.97
Rot. Bonds4

About [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol

[1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol (PubChem CID 115455152) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol
PubChem CID115455152
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name[1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol
SMILESCc1ccc(NCC2(CO)CC2)nn1
InChIInChI=1S/C10H15N3O/c1-8-2-3-9(13-12-8)11-6-10(7-14)4-5-10/h2-3,14H,4-7H2,1H3,(H,11,13)
InChIKeyCYJLITFDUKXNBQ-UHFFFAOYSA-N
XLogP0.97
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopropyl]methanol
CID 107874814
2-[[1-(hydroxymethyl)cyclopropyl]methylamino]-6-methylpyridine-3-carboxylic acid
CID 115455529
[1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol
CID 115454120
[1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol
CID 106549888
N-[[1-(hydroxymethyl)cyclopropyl]methyl]-3,6-dimethylpyridazine-4-carboxamide
CID 112548491
[1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol
CID 114448681
[1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol
CID 79478877
[1-[[(4-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol
CID 115455218
methyl 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyridazine-3-carboxylate
CID 114749606
[1-[[[2-(ethylamino)pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
CID 115457191
6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide
CID 113256808
1-[(6-methylpyridazin-3-yl)amino]propan-2-one
CID 116972083

Frequently Asked Questions

What is the IUPAC name of [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol (CID 115455152) is [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol is Cc1ccc(NCC2(CO)CC2)nn1.
What is the InChIKey of [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol?
The InChIKey is CYJLITFDUKXNBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-8-2-3-9(13-12-8)11-6-10(7-14)4-5-10/h2-3,14H,4-7H2,1H3,(H,11,13).
What are the key properties of [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol?
[1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol has a molecular weight of 193.25 g/mol, XLogP of 0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 115455152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).