N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine

C19H15N5O — CID 59374061

IUPACN-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine
SMILESc1ccc(Nc2ccc(Oc3ncccc3-c3cn[nH]c3)cc2)nc1
InChIInChI=1S/C19H15N5O/c1-2-10-20-18(5-1)24-15-6-8-16(9-7-15)25-19-17(4-3-11-21-19)14-12-22-23-13-14/h1-13H,(H,20,24)(H,22,23)
InChIKeyGKHQJLQGFWMHKW-UHFFFAOYSA-N
MW329.36 g/mol
LogP4.40
Rot. Bonds5

About N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine

N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine (PubChem CID 59374061) has the molecular formula C19H15N5O and a molecular weight of 329.36 g/mol. Its IUPAC name is N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine
PubChem CID59374061
Molecular FormulaC19H15N5O
Molecular Weight329.36 g/mol
Exact Mass329.13
IUPAC NameN-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine
SMILESc1ccc(Nc2ccc(Oc3ncccc3-c3cn[nH]c3)cc2)nc1
InChIInChI=1S/C19H15N5O/c1-2-10-20-18(5-1)24-15-6-8-16(9-7-15)25-19-17(4-3-11-21-19)14-12-22-23-13-14/h1-13H,(H,20,24)(H,22,23)
InChIKeyGKHQJLQGFWMHKW-UHFFFAOYSA-N
XLogP4.40
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine?
The IUPAC name of N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine (CID 59374061) is N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine.
What is the SMILES notation for N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine?
The canonical SMILES for N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine is c1ccc(Nc2ccc(Oc3ncccc3-c3cn[nH]c3)cc2)nc1.
What is the InChIKey of N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine?
The InChIKey is GKHQJLQGFWMHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O/c1-2-10-20-18(5-1)24-15-6-8-16(9-7-15)25-19-17(4-3-11-21-19)14-12-22-23-13-14/h1-13H,(H,20,24)(H,22,23).
What are the key properties of N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine?
N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine has a molecular weight of 329.36 g/mol, XLogP of 4.40, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[3-(1H-pyrazol-4-yl)-2-pyridinyl]oxy]phenyl]pyridin-2-amine is sourced from PubChem (CID 59374061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).