4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine

C12H22N4 — CID 140925002

IUPAC4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine
SMILESCC(C)(C)N1CCCCC1c1cn[nH]c1N
InChIInChI=1S/C12H22N4/c1-12(2,3)16-7-5-4-6-10(16)9-8-14-15-11(9)13/h8,10H,4-7H2,1-3H3,(H3,13,14,15)
InChIKeyGLPQVSDCVPLWEO-UHFFFAOYSA-N
MW222.34 g/mol
LogP2.32
Rot. Bonds1

About 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine

4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine (PubChem CID 140925002) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine
PubChem CID140925002
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine
SMILESCC(C)(C)N1CCCCC1c1cn[nH]c1N
InChIInChI=1S/C12H22N4/c1-12(2,3)16-7-5-4-6-10(16)9-8-14-15-11(9)13/h8,10H,4-7H2,1-3H3,(H3,13,14,15)
InChIKeyGLPQVSDCVPLWEO-UHFFFAOYSA-N
XLogP2.32
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine (CID 140925002) is 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine is CC(C)(C)N1CCCCC1c1cn[nH]c1N.
What is the InChIKey of 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine?
The InChIKey is GLPQVSDCVPLWEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-12(2,3)16-7-5-4-6-10(16)9-8-14-15-11(9)13/h8,10H,4-7H2,1-3H3,(H3,13,14,15).
What are the key properties of 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine?
4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine has a molecular weight of 222.34 g/mol, XLogP of 2.32, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-tert-butylpiperidin-2-yl)-1H-pyrazol-5-amine is sourced from PubChem (CID 140925002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).