1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine

C12H13N3 — CID 83861524

IUPAC1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine
SMILESNC1CCc2c1cnn2-c1ccccc1
InChIInChI=1S/C12H13N3/c13-11-6-7-12-10(11)8-14-15(12)9-4-2-1-3-5-9/h1-5,8,11H,6-7,13H2
InChIKeySWRLXDJWFMZTHR-UHFFFAOYSA-N
MW199.26 g/mol
LogP1.82
Rot. Bonds1

About 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine

1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine (PubChem CID 83861524) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine.

Molecular Properties

Compound Name1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine
PubChem CID83861524
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine
SMILESNC1CCc2c1cnn2-c1ccccc1
InChIInChI=1S/C12H13N3/c13-11-6-7-12-10(11)8-14-15(12)9-4-2-1-3-5-9/h1-5,8,11H,6-7,13H2
InChIKeySWRLXDJWFMZTHR-UHFFFAOYSA-N
XLogP1.82
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazol-4-amine
CID 107384308
1-phenyl-4,5,6,7-tetrahydroindazol-4-amine;hydrochloride
CID 129104721
2-[2-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-yl)ethyl]-1,3-dihydroisoindole
CID 11502629
1-(4-methoxyphenyl)-4,5,6,7-tetrahydroindazol-4-amine
CID 44819704
(4S)-1-(2-fluorophenyl)-4,5,6,7-tetrahydroindazol-4-amine
CID 96730162
(4S)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine
CID 92546797
N-benzyl-N-methyl-2-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-yl)ethanamine
CID 11695647
(4S)-1-(3,4-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-amine
CID 94133505
3-[4-(aminomethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]phenol
CID 83861544
1-(2-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazol-4-amine
CID 107384454
4-[2-(4-methylpiperidin-1-yl)ethyl]-1-phenyl-4,5,6,7-tetrahydroindazole
CID 11524449
(4S)-1-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine
CID 97181754

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine?
The IUPAC name of 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine (CID 83861524) is 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine.
What is the SMILES notation for 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine?
The canonical SMILES for 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine is NC1CCc2c1cnn2-c1ccccc1.
What is the InChIKey of 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine?
The InChIKey is SWRLXDJWFMZTHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c13-11-6-7-12-10(11)8-14-15(12)9-4-2-1-3-5-9/h1-5,8,11H,6-7,13H2.
What are the key properties of 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine?
1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine has a molecular weight of 199.26 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine is sourced from PubChem (CID 83861524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).