methyl 2-[(6-propylpyridazin-3-yl)amino]acetate

C10H15N3O2 — CID 116971973

IUPACmethyl 2-[(6-propylpyridazin-3-yl)amino]acetate
SMILESCCCc1ccc(NCC(=O)OC)nn1
InChIInChI=1S/C10H15N3O2/c1-3-4-8-5-6-9(13-12-8)11-7-10(14)15-2/h5-6H,3-4,7H2,1-2H3,(H,11,13)
InChIKeyMLCQDDSUYCCAJU-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.01
Rot. Bonds5

About methyl 2-[(6-propylpyridazin-3-yl)amino]acetate

methyl 2-[(6-propylpyridazin-3-yl)amino]acetate (PubChem CID 116971973) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is methyl 2-[(6-propylpyridazin-3-yl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[(6-propylpyridazin-3-yl)amino]acetate
PubChem CID116971973
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Namemethyl 2-[(6-propylpyridazin-3-yl)amino]acetate
SMILESCCCc1ccc(NCC(=O)OC)nn1
InChIInChI=1S/C10H15N3O2/c1-3-4-8-5-6-9(13-12-8)11-7-10(14)15-2/h5-6H,3-4,7H2,1-2H3,(H,11,13)
InChIKeyMLCQDDSUYCCAJU-UHFFFAOYSA-N
XLogP1.01
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[(6-propylpyrimidin-4-yl)amino]acetate
CID 61240139
methyl 2-[(6-pyridin-4-ylpyridazin-3-yl)amino]acetate
CID 116971994
methyl 2-[[6-(propylamino)-2-pyridinyl]amino]acetate
CID 80778103
methyl 2-[(5-amino-6-propoxy-2-pyridinyl)amino]acetate
CID 43261097
methyl 2-[(5-fluoro-2-pyridinyl)amino]acetate
CID 61312351
1-N,2-dimethyl-2-N-(6-propylpyridazin-3-yl)propane-1,2-diamine
CID 116971625
2-methyl-2-[(6-propylpyridazin-3-yl)amino]propanenitrile
CID 116972037
methyl 2-(pyridin-2-ylamino)acetate;hydrochloride
CID 18418885
methyl 2-[(6-fluoro-2-pyridinyl)amino]acetate
CID 54594897
N-(2-piperidin-4-ylethyl)-6-propylpyridazin-3-amine
CID 116972215
methyl 2-[(3-chloro-1,2,4-triazin-5-yl)amino]acetate
CID 114999415
N-(azetidin-3-yl)-6-propylpyridazin-3-amine
CID 116970918

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(6-propylpyridazin-3-yl)amino]acetate?
The IUPAC name of methyl 2-[(6-propylpyridazin-3-yl)amino]acetate (CID 116971973) is methyl 2-[(6-propylpyridazin-3-yl)amino]acetate.
What is the SMILES notation for methyl 2-[(6-propylpyridazin-3-yl)amino]acetate?
The canonical SMILES for methyl 2-[(6-propylpyridazin-3-yl)amino]acetate is CCCc1ccc(NCC(=O)OC)nn1.
What is the InChIKey of methyl 2-[(6-propylpyridazin-3-yl)amino]acetate?
The InChIKey is MLCQDDSUYCCAJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-3-4-8-5-6-9(13-12-8)11-7-10(14)15-2/h5-6H,3-4,7H2,1-2H3,(H,11,13).
What are the key properties of methyl 2-[(6-propylpyridazin-3-yl)amino]acetate?
methyl 2-[(6-propylpyridazin-3-yl)amino]acetate has a molecular weight of 209.25 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(6-propylpyridazin-3-yl)amino]acetate is sourced from PubChem (CID 116971973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).