4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine

C16H19F2N3 — CID 66475954

IUPAC4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine
SMILESCC1(C)C(c2[nH]nc(N)c2-c2ccc(F)cc2F)C1(C)C
InChIInChI=1S/C16H19F2N3/c1-15(2)13(16(15,3)4)12-11(14(19)21-20-12)9-6-5-8(17)7-10(9)18/h5-7,13H,1-4H3,(H3,19,20,21)
InChIKeySLNWTIAHZDQTIM-UHFFFAOYSA-N
MW291.34 g/mol
LogP4.09
Rot. Bonds2

About 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine

4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine (PubChem CID 66475954) has the molecular formula C16H19F2N3 and a molecular weight of 291.34 g/mol. Its IUPAC name is 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine
PubChem CID66475954
Molecular FormulaC16H19F2N3
Molecular Weight291.34 g/mol
Exact Mass291.15
IUPAC Name4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine
SMILESCC1(C)C(c2[nH]nc(N)c2-c2ccc(F)cc2F)C1(C)C
InChIInChI=1S/C16H19F2N3/c1-15(2)13(16(15,3)4)12-11(14(19)21-20-12)9-6-5-8(17)7-10(9)18/h5-7,13H,1-4H3,(H3,19,20,21)
InChIKeySLNWTIAHZDQTIM-UHFFFAOYSA-N
XLogP4.09
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.34
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-cycloheptyl-4-(2,4-difluorophenyl)-1H-pyrazol-3-amine
CID 64561244
4-(2,4-difluorophenyl)-5-(oxan-3-yl)-1H-pyrazol-3-amine
CID 64559125
4-(2,4-difluorophenyl)-5-(trifluoromethyl)-1H-pyrazol-3-amine
CID 64560664
4-(2,4-difluorophenyl)-5-(4-methylthiophen-3-yl)-1H-pyrazol-3-amine
CID 79803023
4-(2,4-difluorophenyl)-5-(4,5-dimethylthiophen-2-yl)-1H-pyrazol-3-amine
CID 65238813
5-(5-bromothiophen-2-yl)-4-(2,4-difluorophenyl)-1H-pyrazol-3-amine
CID 64560666
4-(3-methoxyphenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine
CID 66477859
5-(4,5-dibromothiophen-2-yl)-4-(2,4-difluorophenyl)-1H-pyrazol-3-amine
CID 80535112
5-(3-chlorophenyl)-4-(2,4-difluorophenyl)-1H-pyrazol-3-amine
CID 64558550
5-(2,5-dichlorothiophen-3-yl)-4-(2,4-difluorophenyl)-1H-pyrazol-3-amine
CID 107962721
4-(2-chloro-4-fluorophenyl)-5-cycloheptyl-1H-pyrazol-3-amine
CID 63525734
4-(2,4-difluorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine
CID 107186064

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine?
The IUPAC name of 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine (CID 66475954) is 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine?
The canonical SMILES for 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine is CC1(C)C(c2[nH]nc(N)c2-c2ccc(F)cc2F)C1(C)C.
What is the InChIKey of 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine?
The InChIKey is SLNWTIAHZDQTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19F2N3/c1-15(2)13(16(15,3)4)12-11(14(19)21-20-12)9-6-5-8(17)7-10(9)18/h5-7,13H,1-4H3,(H3,19,20,21).
What are the key properties of 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine?
4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine has a molecular weight of 291.34 g/mol, XLogP of 4.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-difluorophenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 66475954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).