4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine

C18H19N3 — CID 117444749

IUPAC4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine
SMILESCC(C)c1ccc(-c2cn[nH]c2N)cc1-c1ccccc1
InChIInChI=1S/C18H19N3/c1-12(2)15-9-8-14(17-11-20-21-18(17)19)10-16(15)13-6-4-3-5-7-13/h3-12H,1-2H3,(H3,19,20,21)
InChIKeyRMMZEPHHPIPYKT-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.45
Rot. Bonds3

About 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine

4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine (PubChem CID 117444749) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine
PubChem CID117444749
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine
SMILESCC(C)c1ccc(-c2cn[nH]c2N)cc1-c1ccccc1
InChIInChI=1S/C18H19N3/c1-12(2)15-9-8-14(17-11-20-21-18(17)19)10-16(15)13-6-4-3-5-7-13/h3-12H,1-2H3,(H3,19,20,21)
InChIKeyRMMZEPHHPIPYKT-UHFFFAOYSA-N
XLogP4.45
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[3-(1-fluoroethyl)phenyl]-1H-pyrazol-5-amine
CID 117293410
2-propan-2-ylbicyclo[3.1.0]hexa-1,3,5-triene
CID 69105545
2-(4-methylphenyl)-4-phenyl-1-propan-2-ylbenzene
CID 163504482
4-(5-ethyl-2-propan-2-ylphenyl)-1H-pyrazol-5-amine
CID 117331142
3-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazole-5-carboxylic acid
CID 117491617
4-(4-bromophenyl)-1H-pyrazol-5-amine
CID 17390115
4-(3-pentan-3-ylphenyl)-1H-pyrazol-5-amine
CID 117331143
4-(3-chloro-1-methylindazol-6-yl)-1H-pyrazol-5-amine
CID 117372451
4-(4-bromo-3-methylphenyl)-1H-pyrazol-5-amine
CID 117383094
4-(3-methylbenzimidazol-5-yl)-1H-pyrazol-5-amine
CID 117304063
3-[4-(5-amino-2-propan-2-ylphenyl)phenyl]-4-propan-2-ylaniline
CID 23166060
2-(5-amino-1H-pyrazol-4-yl)-4-bromo-5-propan-2-ylphenol
CID 117477121

Frequently Asked Questions

What is the IUPAC name of 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine (CID 117444749) is 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine is CC(C)c1ccc(-c2cn[nH]c2N)cc1-c1ccccc1.
What is the InChIKey of 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine?
The InChIKey is RMMZEPHHPIPYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-12(2)15-9-8-14(17-11-20-21-18(17)19)10-16(15)13-6-4-3-5-7-13/h3-12H,1-2H3,(H3,19,20,21).
What are the key properties of 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine?
4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine has a molecular weight of 277.37 g/mol, XLogP of 4.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenyl-4-propan-2-ylphenyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 117444749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).