5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine

C19H22N6 — CID 146135697

IUPAC5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine
SMILESc1cc(-n2nccc2CNc2ccc(N3CCCCC3)cn2)ccn1
InChIInChI=1S/C19H22N6/c1-2-12-24(13-3-1)17-4-5-19(21-14-17)22-15-18-8-11-23-25(18)16-6-9-20-10-7-16/h4-11,14H,1-3,12-13,15H2,(H,21,22)
InChIKeyGZWUFFMNEDGYCY-UHFFFAOYSA-N
MW334.43 g/mol
LogP3.26
Rot. Bonds5

About 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine

5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine (PubChem CID 146135697) has the molecular formula C19H22N6 and a molecular weight of 334.43 g/mol. Its IUPAC name is 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine
PubChem CID146135697
Molecular FormulaC19H22N6
Molecular Weight334.43 g/mol
Exact Mass334.19
IUPAC Name5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine
SMILESc1cc(-n2nccc2CNc2ccc(N3CCCCC3)cn2)ccn1
InChIInChI=1S/C19H22N6/c1-2-12-24(13-3-1)17-4-5-19(21-14-17)22-15-18-8-11-23-25(18)16-6-9-20-10-7-16/h4-11,14H,1-3,12-13,15H2,(H,21,22)
InChIKeyGZWUFFMNEDGYCY-UHFFFAOYSA-N
XLogP3.26
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.43
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine?
The IUPAC name of 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine (CID 146135697) is 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine?
The canonical SMILES for 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine is c1cc(-n2nccc2CNc2ccc(N3CCCCC3)cn2)ccn1.
What is the InChIKey of 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine?
The InChIKey is GZWUFFMNEDGYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6/c1-2-12-24(13-3-1)17-4-5-19(21-14-17)22-15-18-8-11-23-25(18)16-6-9-20-10-7-16/h4-11,14H,1-3,12-13,15H2,(H,21,22).
What are the key properties of 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine?
5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine has a molecular weight of 334.43 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-1-yl-N-[(2-pyridin-4-ylpyrazol-3-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 146135697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).