N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine

C15H14N4 — CID 61167306

IUPACN-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine
SMILESc1ccc(-n2cccn2)c(CNc2ccncc2)c1
InChIInChI=1S/C15H14N4/c1-2-5-15(19-11-3-8-18-19)13(4-1)12-17-14-6-9-16-10-7-14/h1-11H,12H2,(H,16,17)
InChIKeyVADDIKRLIFXCMI-UHFFFAOYSA-N
MW250.31 g/mol
LogP2.88
Rot. Bonds4

About N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine

N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine (PubChem CID 61167306) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine
PubChem CID61167306
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC NameN-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine
SMILESc1ccc(-n2cccn2)c(CNc2ccncc2)c1
InChIInChI=1S/C15H14N4/c1-2-5-15(19-11-3-8-18-19)13(4-1)12-17-14-6-9-16-10-7-14/h1-11H,12H2,(H,16,17)
InChIKeyVADDIKRLIFXCMI-UHFFFAOYSA-N
XLogP2.88
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine
CID 103756564
N-[(2-pyrazol-1-ylphenyl)methyl]-1-pyridin-4-ylmethanamine
CID 61165719
5-chloro-N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-2-amine
CID 61166350
N-[(2-fluorophenyl)methyl]-1-(2-pyrazol-1-ylphenyl)methanamine
CID 61167301
2-fluoro-N-[(2-pyrazol-1-ylphenyl)methyl]ethanamine
CID 80693727
2-methylsulfonyl-N-[(2-pyrazol-1-ylphenyl)methyl]aniline
CID 133270594
3-N,3-N-dimethyl-2-N-[(2-pyrazol-1-ylphenyl)methyl]pyrazine-2,3-diamine
CID 134714332
1-[2-(pyrazol-1-ylmethyl)phenyl]pyrazole
CID 101492467
3-propan-2-yl-N-[(2-pyrazol-1-ylphenyl)methyl]-1,2,4-thiadiazol-5-amine
CID 65276920
3-bromo-5-chloro-N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-2-amine
CID 114835748
N-[(2-pyrazol-1-ylphenyl)methyl]methanesulfonamide
CID 47454487
5-phenyl-N-[(2-pyrazol-1-ylphenyl)methyl]-1,2,4-oxadiazol-3-amine
CID 133482509

Frequently Asked Questions

What is the IUPAC name of N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine?
The IUPAC name of N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine (CID 61167306) is N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine.
What is the SMILES notation for N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine?
The canonical SMILES for N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine is c1ccc(-n2cccn2)c(CNc2ccncc2)c1.
What is the InChIKey of N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine?
The InChIKey is VADDIKRLIFXCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-2-5-15(19-11-3-8-18-19)13(4-1)12-17-14-6-9-16-10-7-14/h1-11H,12H2,(H,16,17).
What are the key properties of N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine?
N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine has a molecular weight of 250.31 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-pyrazol-1-ylphenyl)methyl]pyridin-4-amine is sourced from PubChem (CID 61167306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).