5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine

C12H16N4O — CID 104536945

IUPAC5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine
SMILESCCCNc1cncc(Oc2cc(C)[nH]n2)c1
InChIInChI=1S/C12H16N4O/c1-3-4-14-10-6-11(8-13-7-10)17-12-5-9(2)15-16-12/h5-8,14H,3-4H2,1-2H3,(H,15,16)
InChIKeyNNFWVUDBHJWRGG-UHFFFAOYSA-N
MW232.29 g/mol
LogP2.73
Rot. Bonds5

About 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine

5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine (PubChem CID 104536945) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine.

Molecular Properties

Compound Name5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine
PubChem CID104536945
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine
SMILESCCCNc1cncc(Oc2cc(C)[nH]n2)c1
InChIInChI=1S/C12H16N4O/c1-3-4-14-10-6-11(8-13-7-10)17-12-5-9(2)15-16-12/h5-8,14H,3-4H2,1-2H3,(H,15,16)
InChIKeyNNFWVUDBHJWRGG-UHFFFAOYSA-N
XLogP2.73
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(5-bromo-3-pyridinyl)oxy]-N-propylpyridin-3-amine
CID 104536852
5-(3-tert-butylphenoxy)-N-propylpyridin-3-amine
CID 104536558
5-(2,3-dimethylphenoxy)-N-propylpyridin-3-amine
CID 104536354
5-(2-methyl-5-propan-2-ylphenoxy)-N-propylpyridin-3-amine
CID 104536595
5-butoxy-N-propylpyridin-3-amine
CID 104536219
5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine
CID 116806496
5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine
CID 104536489
N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine
CID 104536494
5-(5-bromo-2,3-difluorophenoxy)-N-propylpyridin-3-amine
CID 107102609
5-N-(2-ethoxyethyl)-3-N-propylpyridine-3,5-diamine
CID 104533066
5-(4-ethyl-2-methoxyphenoxy)-N-propylpyridin-3-amine
CID 107669663
5-(4-methyl-2-nitrophenoxy)-N-propylpyridin-3-amine
CID 104536675

Frequently Asked Questions

What is the IUPAC name of 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine?
The IUPAC name of 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine (CID 104536945) is 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine.
What is the SMILES notation for 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine?
The canonical SMILES for 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine is CCCNc1cncc(Oc2cc(C)[nH]n2)c1.
What is the InChIKey of 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine?
The InChIKey is NNFWVUDBHJWRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-3-4-14-10-6-11(8-13-7-10)17-12-5-9(2)15-16-12/h5-8,14H,3-4H2,1-2H3,(H,15,16).
What are the key properties of 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine?
5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine has a molecular weight of 232.29 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine is sourced from PubChem (CID 104536945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).