1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine

C15H20N4 — CID 43540095

IUPAC1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine
SMILESc1ccc(CN2CCC(Nc3cn[nH]c3)CC2)cc1
InChIInChI=1S/C15H20N4/c1-2-4-13(5-3-1)12-19-8-6-14(7-9-19)18-15-10-16-17-11-15/h1-5,10-11,14,18H,6-9,12H2,(H,16,17)
InChIKeyOXTAVFLLUBAOIJ-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.49
Rot. Bonds4

About 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine

1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine (PubChem CID 43540095) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine
PubChem CID43540095
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine
SMILESc1ccc(CN2CCC(Nc3cn[nH]c3)CC2)cc1
InChIInChI=1S/C15H20N4/c1-2-4-13(5-3-1)12-19-8-6-14(7-9-19)18-15-10-16-17-11-15/h1-5,10-11,14,18H,6-9,12H2,(H,16,17)
InChIKeyOXTAVFLLUBAOIJ-UHFFFAOYSA-N
XLogP2.49
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-phenylethyl)-N-(1H-pyrazol-4-yl)piperidin-4-amine
CID 60797118
N-(1-benzylpiperidin-4-yl)-5-bromopyridin-3-amine
CID 115656855
N-(1-benzylpiperidin-4-yl)-5-bromopyridin-2-amine
CID 29049157
N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine
CID 22933598
3-[(1-benzylpiperidin-4-yl)amino]phenol
CID 28722324
1-N-(1-benzylpiperidin-4-yl)-4-N,4-N-dimethylbenzene-1,4-diamine
CID 90316616
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine
CID 141333919
2-N,4-N-bis(1-benzylpiperidin-4-yl)pyrimidine-2,4-diamine
CID 117081882
4-N-(1-benzylpiperidin-4-yl)-2-methoxybenzene-1,4-diamine
CID 58608359
2-N,4-N-bis(1-benzylpiperidin-4-yl)-6-methylpyrimidine-2,4-diamine
CID 117084915
1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperidin-4-amine
CID 118997215

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine?
The IUPAC name of 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine (CID 43540095) is 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine.
What is the SMILES notation for 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine?
The canonical SMILES for 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine is c1ccc(CN2CCC(Nc3cn[nH]c3)CC2)cc1.
What is the InChIKey of 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine?
The InChIKey is OXTAVFLLUBAOIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-2-4-13(5-3-1)12-19-8-6-14(7-9-19)18-15-10-16-17-11-15/h1-5,10-11,14,18H,6-9,12H2,(H,16,17).
What are the key properties of 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine?
1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine is sourced from PubChem (CID 43540095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).