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

C11H17N3O — CID 126838288

IUPAC[1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol
SMILESCc1ccc(N(C)CC2(CO)CC2)nn1
InChIInChI=1S/C11H17N3O/c1-9-3-4-10(13-12-9)14(2)7-11(8-15)5-6-11/h3-4,15H,5-8H2,1-2H3
InChIKeyZVNHDNCNUSRCDR-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.99
Rot. Bonds4

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

[1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol (PubChem CID 126838288) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol
PubChem CID126838288
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name[1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol
SMILESCc1ccc(N(C)CC2(CO)CC2)nn1
InChIInChI=1S/C11H17N3O/c1-9-3-4-10(13-12-9)14(2)7-11(8-15)5-6-11/h3-4,15H,5-8H2,1-2H3
InChIKeyZVNHDNCNUSRCDR-UHFFFAOYSA-N
XLogP0.99
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol (CID 126838288) is [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol is Cc1ccc(N(C)CC2(CO)CC2)nn1.
What is the InChIKey of [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol?
The InChIKey is ZVNHDNCNUSRCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-9-3-4-10(13-12-9)14(2)7-11(8-15)5-6-11/h3-4,15H,5-8H2,1-2H3.
What are the key properties of [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol?
[1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol has a molecular weight of 207.28 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[methyl-(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 126838288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).