1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine

C15H20N4 — CID 114697748

IUPAC1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine
SMILESCc1[nH]nc(N2CCC(N)CC2)c1-c1ccccc1
InChIInChI=1S/C15H20N4/c1-11-14(12-5-3-2-4-6-12)15(18-17-11)19-9-7-13(16)8-10-19/h2-6,13H,7-10,16H2,1H3,(H,17,18)
InChIKeyPVMSFLNGBVICAK-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.31
Rot. Bonds2

About 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine

1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine (PubChem CID 114697748) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine
PubChem CID114697748
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine
SMILESCc1[nH]nc(N2CCC(N)CC2)c1-c1ccccc1
InChIInChI=1S/C15H20N4/c1-11-14(12-5-3-2-4-6-12)15(18-17-11)19-9-7-13(16)8-10-19/h2-6,13H,7-10,16H2,1H3,(H,17,18)
InChIKeyPVMSFLNGBVICAK-UHFFFAOYSA-N
XLogP2.31
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine?
The IUPAC name of 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine (CID 114697748) is 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine.
What is the SMILES notation for 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine?
The canonical SMILES for 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine is Cc1[nH]nc(N2CCC(N)CC2)c1-c1ccccc1.
What is the InChIKey of 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine?
The InChIKey is PVMSFLNGBVICAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-11-14(12-5-3-2-4-6-12)15(18-17-11)19-9-7-13(16)8-10-19/h2-6,13H,7-10,16H2,1H3,(H,17,18).
What are the key properties of 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine?
1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-4-phenyl-1H-pyrazol-3-yl)piperidin-4-amine is sourced from PubChem (CID 114697748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).