1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine

C12H12ClN3 — CID 83895833

IUPAC1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine
SMILESNC1CCc2cnn(-c3ccccc3Cl)c21
InChIInChI=1S/C12H12ClN3/c13-9-3-1-2-4-11(9)16-12-8(7-15-16)5-6-10(12)14/h1-4,7,10H,5-6,14H2
InChIKeyWBDPMSUDIYMZKN-UHFFFAOYSA-N
MW233.70 g/mol
LogP2.47
Rot. Bonds1

About 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine

1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine (PubChem CID 83895833) has the molecular formula C12H12ClN3 and a molecular weight of 233.70 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine
PubChem CID83895833
Molecular FormulaC12H12ClN3
Molecular Weight233.70 g/mol
Exact Mass233.07
IUPAC Name1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine
SMILESNC1CCc2cnn(-c3ccccc3Cl)c21
InChIInChI=1S/C12H12ClN3/c13-9-3-1-2-4-11(9)16-12-8(7-15-16)5-6-10(12)14/h1-4,7,10H,5-6,14H2
InChIKeyWBDPMSUDIYMZKN-UHFFFAOYSA-N
XLogP2.47
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.70
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(2-chlorophenyl)-5-cyclopropylpyrazol-4-yl]piperazine
CID 117210825
(3bS,8bR)-3,8-diphenyl-3b,4,5,8b,9,10-hexahydroindazolo[7,6-g]indazole
CID 90673957
N-[[1-(2-chlorophenyl)-5-cyclopropylpyrazol-4-yl]methyl]-2-methylpropan-2-amine
CID 66440904
1-(2-chlorophenyl)-5,6-dihydrocyclopenta[d]pyrazol-4-one
CID 83868814
1-(2-chlorophenyl)-5-ethylpyrazol-4-amine;hydrochloride
CID 86775399
2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol
CID 83893722
1-[1-(2-chlorophenyl)-5-methylpyrazol-4-yl]ethanamine
CID 43381499
(4S)-5,6-dihydro-4H-imidazo[1,2-a][1]benzazepin-4-amine
CID 67234934
1-(2-chlorophenyl)-5-propan-2-ylpyrazol-4-amine;hydrochloride
CID 86775375
1-(2-chlorophenyl)-3-cyclopropylpyrazol-5-amine
CID 82082963
(3S)-3-amino-1-(2-chlorophenyl)pyrrolidin-2-one
CID 11128620
[(2R,4S)-4-amino-2-methylpiperidin-1-yl]-[1-(2-chlorophenyl)-5-methylpyrazol-4-yl]methanone
CID 124691927

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine?
The IUPAC name of 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine (CID 83895833) is 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine.
What is the SMILES notation for 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine?
The canonical SMILES for 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine is NC1CCc2cnn(-c3ccccc3Cl)c21.
What is the InChIKey of 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine?
The InChIKey is WBDPMSUDIYMZKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3/c13-9-3-1-2-4-11(9)16-12-8(7-15-16)5-6-10(12)14/h1-4,7,10H,5-6,14H2.
What are the key properties of 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine?
1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine has a molecular weight of 233.70 g/mol, XLogP of 2.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-6-amine is sourced from PubChem (CID 83895833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).