3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine

C15H21N5O — CID 103374843

IUPAC3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine
SMILESCCCNC(c1ccc(OC)nn1)c1c(C)ccnc1N
InChIInChI=1S/C15H21N5O/c1-4-8-17-14(11-5-6-12(21-3)20-19-11)13-10(2)7-9-18-15(13)16/h5-7,9,14,17H,4,8H2,1-3H3,(H2,16,18)
InChIKeyDLUOBFNXLATVRK-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.86
Rot. Bonds6

About 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine

3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine (PubChem CID 103374843) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine
PubChem CID103374843
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine
SMILESCCCNC(c1ccc(OC)nn1)c1c(C)ccnc1N
InChIInChI=1S/C15H21N5O/c1-4-8-17-14(11-5-6-12(21-3)20-19-11)13-10(2)7-9-18-15(13)16/h5-7,9,14,17H,4,8H2,1-3H3,(H2,16,18)
InChIKeyDLUOBFNXLATVRK-UHFFFAOYSA-N
XLogP1.86
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-[2,2-dimethoxy-1-(propylamino)ethyl]-4-methylpyridin-2-amine
CID 79493587
3-[2-methoxy-1-(propylamino)propyl]-4-methylpyridin-2-amine
CID 79615875
N-[(6-methoxypyridazin-3-yl)-(3-methylthiophen-2-yl)methyl]propan-1-amine
CID 103374682
4-methyl-3-[propylamino(1H-1,2,4-triazol-5-yl)methyl]pyridin-2-amine
CID 65360572
N-[(2,4-dimethylphenyl)-(6-methoxypyridazin-3-yl)methyl]propan-1-amine
CID 103374840
N-[(6-methoxypyridazin-3-yl)-pyridin-3-ylmethyl]propan-1-amine
CID 103374852
3-[(5-chloro-2-fluorophenyl)-(propylamino)methyl]-4-methylpyridin-2-amine
CID 114886614
N-[(3-chlorophenyl)-(6-methoxypyridazin-3-yl)methyl]propan-1-amine
CID 103374829
N-[(4-bromothiophen-3-yl)-(6-methoxypyridazin-3-yl)methyl]propan-1-amine
CID 103374783
N-[(2,3-difluorophenyl)-(6-methoxypyridazin-3-yl)methyl]propan-1-amine
CID 103374736
N-[(4-methoxy-1-methylpyrazol-5-yl)-(6-methoxypyridazin-3-yl)methyl]propan-1-amine
CID 103374801
3-[(4-methoxyoxan-4-yl)-(propylamino)methyl]-4-methylpyridin-2-amine
CID 116765092

Frequently Asked Questions

What is the IUPAC name of 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine?
The IUPAC name of 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine (CID 103374843) is 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine.
What is the SMILES notation for 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine?
The canonical SMILES for 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine is CCCNC(c1ccc(OC)nn1)c1c(C)ccnc1N.
What is the InChIKey of 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine?
The InChIKey is DLUOBFNXLATVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-4-8-17-14(11-5-6-12(21-3)20-19-11)13-10(2)7-9-18-15(13)16/h5-7,9,14,17H,4,8H2,1-3H3,(H2,16,18).
What are the key properties of 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine?
3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine has a molecular weight of 287.37 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-methoxypyridazin-3-yl)-(propylamino)methyl]-4-methylpyridin-2-amine is sourced from PubChem (CID 103374843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).