N-(3-pyrazol-1-ylphenyl)pyridin-4-amine

C14H12N4 — CID 162626187

IUPACN-(3-pyrazol-1-ylphenyl)pyridin-4-amine
SMILESc1cc(Nc2ccncc2)cc(-n2cccn2)c1
InChIInChI=1S/C14H12N4/c1-3-13(17-12-5-8-15-9-6-12)11-14(4-1)18-10-2-7-16-18/h1-11H,(H,15,17)
InChIKeyHFFHMOYVDMYQTO-UHFFFAOYSA-N
MW236.28 g/mol
LogP3.01
Rot. Bonds3

About N-(3-pyrazol-1-ylphenyl)pyridin-4-amine

N-(3-pyrazol-1-ylphenyl)pyridin-4-amine (PubChem CID 162626187) has the molecular formula C14H12N4 and a molecular weight of 236.28 g/mol. Its IUPAC name is N-(3-pyrazol-1-ylphenyl)pyridin-4-amine.

Molecular Properties

Compound NameN-(3-pyrazol-1-ylphenyl)pyridin-4-amine
PubChem CID162626187
Molecular FormulaC14H12N4
Molecular Weight236.28 g/mol
Exact Mass236.11
IUPAC NameN-(3-pyrazol-1-ylphenyl)pyridin-4-amine
SMILESc1cc(Nc2ccncc2)cc(-n2cccn2)c1
InChIInChI=1S/C14H12N4/c1-3-13(17-12-5-8-15-9-6-12)11-14(4-1)18-10-2-7-16-18/h1-11H,(H,15,17)
InChIKeyHFFHMOYVDMYQTO-UHFFFAOYSA-N
XLogP3.01
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chlorophenyl)-3-pyrazol-1-ylaniline
CID 162634741
3-pyrazol-1-yl-N-[3-(1,2,4-triazol-4-yl)phenyl]aniline
CID 162626213
N-(3-pyrazol-1-ylphenyl)pyridin-2-amine
CID 162630753
N-(3-pyrazol-1-ylphenyl)quinolin-3-amine
CID 162635420
N-(3-methylbutan-2-yl)-3-pyrazol-1-ylaniline
CID 43739992
3-oxo-3-(3-pyrazol-1-ylanilino)propanoic acid
CID 55049356
2-(3-pyrazol-1-ylanilino)pyridine-4-carboxamide
CID 162627810
(E)-N-(3-pyrazol-1-ylphenyl)but-2-enamide
CID 110470249
N-(dicyclopropylmethyl)-3-pyrazol-1-ylaniline
CID 43740005
ethyl N-(3-pyrazol-1-ylphenyl)carbamate
CID 61061847
5-oxo-5-(3-pyrazol-1-ylanilino)pentanoic acid
CID 60940474
3-pyrazol-1-yl-N-(1,3-thiazol-5-ylmethyl)aniline
CID 55109620

Frequently Asked Questions

What is the IUPAC name of N-(3-pyrazol-1-ylphenyl)pyridin-4-amine?
The IUPAC name of N-(3-pyrazol-1-ylphenyl)pyridin-4-amine (CID 162626187) is N-(3-pyrazol-1-ylphenyl)pyridin-4-amine.
What is the SMILES notation for N-(3-pyrazol-1-ylphenyl)pyridin-4-amine?
The canonical SMILES for N-(3-pyrazol-1-ylphenyl)pyridin-4-amine is c1cc(Nc2ccncc2)cc(-n2cccn2)c1.
What is the InChIKey of N-(3-pyrazol-1-ylphenyl)pyridin-4-amine?
The InChIKey is HFFHMOYVDMYQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4/c1-3-13(17-12-5-8-15-9-6-12)11-14(4-1)18-10-2-7-16-18/h1-11H,(H,15,17).
What are the key properties of N-(3-pyrazol-1-ylphenyl)pyridin-4-amine?
N-(3-pyrazol-1-ylphenyl)pyridin-4-amine has a molecular weight of 236.28 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyrazol-1-ylphenyl)pyridin-4-amine is sourced from PubChem (CID 162626187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).