4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine

C8H12FN3 — CID 105434102

IUPAC4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine
SMILESCn1nc(N)c2c1CCC2(C)F
InChIInChI=1S/C8H12FN3/c1-8(9)4-3-5-6(8)7(10)11-12(5)2/h3-4H2,1-2H3,(H2,10,11)
InChIKeyKGZFYAWSUUTDRI-UHFFFAOYSA-N
MW169.20 g/mol
LogP1.13
Rot. Bonds

About 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine

4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine (PubChem CID 105434102) has the molecular formula C8H12FN3 and a molecular weight of 169.20 g/mol. Its IUPAC name is 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine.

Molecular Properties

Compound Name4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine
PubChem CID105434102
Molecular FormulaC8H12FN3
Molecular Weight169.20 g/mol
Exact Mass169.10
IUPAC Name4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine
SMILESCn1nc(N)c2c1CCC2(C)F
InChIInChI=1S/C8H12FN3/c1-8(9)4-3-5-6(8)7(10)11-12(5)2/h3-4H2,1-2H3,(H2,10,11)
InChIKeyKGZFYAWSUUTDRI-UHFFFAOYSA-N
XLogP1.13
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.20
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine with MolForge

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Related Compounds

Mls002707355
CID 276384
2-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-3-amine
CID 16227065
2-(propan-2-yl)-2H,4H,5H,6H-cyclopenta[c]pyrazol-3-amine
CID 65348359
1-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine
CID 71668509
3,4-Diethyl-1-methyl-1H-pyrazol-5-amine
CID 28064035
N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanesulfonamide
CID 127920482
2-methyl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole
CID 90167567
1-Methyl-3-(trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole
CID 90167781
(4S,5R)-6,6-difluoro-N,N,4,5-tetramethyl-4,5-dihydro-1H-cyclopenta[d]pyrazol-3-amine
CID 117637984
2-(2,2,2-Trifluoroethyl)-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-amine
CID 118340615
(2S,4R)-7-tert-butyl-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-amine
CID 118967307
(2S,4R)-5,5-difluoro-7-methyl-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-amine
CID 118971755

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine?
The IUPAC name of 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine (CID 105434102) is 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine.
What is the SMILES notation for 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine?
The canonical SMILES for 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine is Cn1nc(N)c2c1CCC2(C)F.
What is the InChIKey of 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine?
The InChIKey is KGZFYAWSUUTDRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12FN3/c1-8(9)4-3-5-6(8)7(10)11-12(5)2/h3-4H2,1-2H3,(H2,10,11).
What are the key properties of 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine?
4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine has a molecular weight of 169.20 g/mol, XLogP of 1.13, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1,4-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-3-amine is sourced from PubChem (CID 105434102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).