3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol

C8H13N3O — CID 83854580

IUPAC3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol
SMILESCn1nc(CN)c2c1CC(O)C2
InChIInChI=1S/C8H13N3O/c1-11-8-3-5(12)2-6(8)7(4-9)10-11/h5,12H,2-4,9H2,1H3
InChIKeyZWRYXIPNXYWYEW-UHFFFAOYSA-N
MW167.21 g/mol
LogP-0.66
Rot. Bonds1

About 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol

3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol (PubChem CID 83854580) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol.

Molecular Properties

Compound Name3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol
PubChem CID83854580
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol
SMILESCn1nc(CN)c2c1CC(O)C2
InChIInChI=1S/C8H13N3O/c1-11-8-3-5(12)2-6(8)7(4-9)10-11/h5,12H,2-4,9H2,1H3
InChIKeyZWRYXIPNXYWYEW-UHFFFAOYSA-N
XLogP-0.66
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-5-ol
CID 71204422
1-methyl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-5-ol
CID 90167802
1-ethyl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-5-ol
CID 129129812
2-(2,4,5-Trimethylpyrazol-3-yl)ethanol
CID 83674251
2,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 142322190
1-amino-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-2-ol
CID 82407064
3-(aminomethyl)-1-benzyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol
CID 83854079
5-hydroxy-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonitrile
CID 83854576
3-(Aminomethyl)-1-methyl-4,5,6,7-tetrahydroindazol-6-ol
CID 83854749
3-(2-aminoethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 83863530
1-methyl-3-(methylaminomethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 83863532
3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 83863533

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol?
The IUPAC name of 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol (CID 83854580) is 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol.
What is the SMILES notation for 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol?
The canonical SMILES for 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol is Cn1nc(CN)c2c1CC(O)C2.
What is the InChIKey of 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol?
The InChIKey is ZWRYXIPNXYWYEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-11-8-3-5(12)2-6(8)7(4-9)10-11/h5,12H,2-4,9H2,1H3.
What are the key properties of 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol?
3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol has a molecular weight of 167.21 g/mol, XLogP of -0.66, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-5-ol is sourced from PubChem (CID 83854580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).