4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine

C14H18N4 — CID 117358172

IUPAC4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine
SMILESNc1[nH]ncc1-c1ccc(C2CCNCC2)cc1
InChIInChI=1S/C14H18N4/c15-14-13(9-17-18-14)12-3-1-10(2-4-12)11-5-7-16-8-6-11/h1-4,9,11,16H,5-8H2,(H3,15,17,18)
InChIKeyCEEONXLUCYCYJS-UHFFFAOYSA-N
MW242.33 g/mol
LogP2.13
Rot. Bonds2

About 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine

4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine (PubChem CID 117358172) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine
PubChem CID117358172
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine
SMILESNc1[nH]ncc1-c1ccc(C2CCNCC2)cc1
InChIInChI=1S/C14H18N4/c15-14-13(9-17-18-14)12-3-1-10(2-4-12)11-5-7-16-8-6-11/h1-4,9,11,16H,5-8H2,(H3,15,17,18)
InChIKeyCEEONXLUCYCYJS-UHFFFAOYSA-N
XLogP2.13
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-(1-methylazepan-4-yl)phenyl]-1H-pyrazol-5-amine
CID 117429368
4-(4-piperidin-4-ylphenyl)aniline
CID 116988069
4-(4-bromophenyl)-1H-pyrazol-5-amine
CID 17390115
N-[4-(5-amino-1H-pyrazol-4-yl)phenyl]piperidin-3-amine
CID 141333654
3-(4-piperidin-4-ylphenyl)-1,2-oxazol-5-amine
CID 117360425
4-[4-[4-(4-phenylphenyl)phenyl]phenyl]piperidine
CID 146643621
[4-(4-piperidin-4-ylphenyl)phenyl]methanamine
CID 116988072
4-(4-bromophenyl)piperidine;hydrochloride
CID 44630758
ethane;4-(4-methylphenyl)piperidine
CID 145467036
4-[4-(triazol-2-yl)phenyl]-1H-pyrazol-5-amine
CID 117325187
4-(4-nitrophenyl)-1H-pyrazol-5-amine
CID 28688793
potassium 4-piperidin-4-ylphenolate
CID 143791971

Frequently Asked Questions

What is the IUPAC name of 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine (CID 117358172) is 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine is Nc1[nH]ncc1-c1ccc(C2CCNCC2)cc1.
What is the InChIKey of 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine?
The InChIKey is CEEONXLUCYCYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c15-14-13(9-17-18-14)12-3-1-10(2-4-12)11-5-7-16-8-6-11/h1-4,9,11,16H,5-8H2,(H3,15,17,18).
What are the key properties of 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine?
4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine has a molecular weight of 242.33 g/mol, XLogP of 2.13, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-piperidin-4-ylphenyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 117358172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).