(1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol

C10H15N3O — CID 135190050

IUPAC(1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol
SMILESC=CNc1cc(C)c([C@H](O)CC)nn1
InChIInChI=1S/C10H15N3O/c1-4-8(14)10-7(3)6-9(11-5-2)12-13-10/h5-6,8,14H,2,4H2,1,3H3,(H,11,12)/t8-/m1/s1
InChIKeyKIJUDJDAMYTXEX-MRVPVSSYSA-N
MW193.25 g/mol
LogP1.78
Rot. Bonds4

About (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol

(1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol (PubChem CID 135190050) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol
PubChem CID135190050
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name(1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol
SMILESC=CNc1cc(C)c([C@H](O)CC)nn1
InChIInChI=1S/C10H15N3O/c1-4-8(14)10-7(3)6-9(11-5-2)12-13-10/h5-6,8,14H,2,4H2,1,3H3,(H,11,12)/t8-/m1/s1
InChIKeyKIJUDJDAMYTXEX-MRVPVSSYSA-N
XLogP1.78
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 ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol?
The IUPAC name of (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol (CID 135190050) is (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol.
What is the SMILES notation for (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol?
The canonical SMILES for (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol is C=CNc1cc(C)c([C@H](O)CC)nn1.
What is the InChIKey of (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol?
The InChIKey is KIJUDJDAMYTXEX-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-4-8(14)10-7(3)6-9(11-5-2)12-13-10/h5-6,8,14H,2,4H2,1,3H3,(H,11,12)/t8-/m1/s1.
What are the key properties of (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol?
(1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol has a molecular weight of 193.25 g/mol, XLogP of 1.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[6-(ethenylamino)-4-methylpyridazin-3-yl]propan-1-ol is sourced from PubChem (CID 135190050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).