5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine

C14H20N4O — CID 116806496

IUPAC5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine
SMILESCCCNc1cncc(Oc2cnn(C(C)C)c2)c1
InChIInChI=1S/C14H20N4O/c1-4-5-16-12-6-13(8-15-7-12)19-14-9-17-18(10-14)11(2)3/h6-11,16H,4-5H2,1-3H3
InChIKeyHJFGZCFTOFQKGP-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.47
Rot. Bonds6

About 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine

5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine (PubChem CID 116806496) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine.

Molecular Properties

Compound Name5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine
PubChem CID116806496
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine
SMILESCCCNc1cncc(Oc2cnn(C(C)C)c2)c1
InChIInChI=1S/C14H20N4O/c1-4-5-16-12-6-13(8-15-7-12)19-14-9-17-18(10-14)11(2)3/h6-11,16H,4-5H2,1-3H3
InChIKeyHJFGZCFTOFQKGP-UHFFFAOYSA-N
XLogP3.47
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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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-methyl-5-propan-2-ylphenoxy)-N-propylpyridin-3-amine
CID 104536595
4-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyrimidin-2-amine
CID 116806571
5-bromo-4-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyrimidin-2-amine
CID 116806620
5-butoxy-N-propylpyridin-3-amine
CID 104536219
5-(5-bromo-2,3-difluorophenoxy)-N-propylpyridin-3-amine
CID 107102609
N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine
CID 104536494
5-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyridin-3-amine
CID 104536945
5-(2,3-dimethylphenoxy)-N-propylpyridin-3-amine
CID 104536354
5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine
CID 104536489
2-fluoro-6-[[5-(propylamino)-3-pyridinyl]oxy]benzonitrile
CID 104536574

Frequently Asked Questions

What is the IUPAC name of 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine?
The IUPAC name of 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine (CID 116806496) is 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine.
What is the SMILES notation for 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine?
The canonical SMILES for 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine is CCCNc1cncc(Oc2cnn(C(C)C)c2)c1.
What is the InChIKey of 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine?
The InChIKey is HJFGZCFTOFQKGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-4-5-16-12-6-13(8-15-7-12)19-14-9-17-18(10-14)11(2)3/h6-11,16H,4-5H2,1-3H3.
What are the key properties of 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine?
5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine has a molecular weight of 260.34 g/mol, XLogP of 3.47, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine is sourced from PubChem (CID 116806496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).