4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol

C8H13N3O — CID 83905566

IUPAC4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol
SMILESCc1[nH]nc2c1C(O)(CN)CC2
InChIInChI=1S/C8H13N3O/c1-5-7-6(11-10-5)2-3-8(7,12)4-9/h12H,2-4,9H2,1H3,(H,10,11)
InChIKeyMZCYQYFUPLPZIF-UHFFFAOYSA-N
MW167.21 g/mol
LogP-0.19
Rot. Bonds1

About 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol

4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol (PubChem CID 83905566) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol.

Molecular Properties

Compound Name4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol
PubChem CID83905566
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol
SMILESCc1[nH]nc2c1C(O)(CN)CC2
InChIInChI=1S/C8H13N3O/c1-5-7-6(11-10-5)2-3-8(7,12)4-9/h12H,2-4,9H2,1H3,(H,10,11)
InChIKeyMZCYQYFUPLPZIF-UHFFFAOYSA-N
XLogP-0.19
TPSA74.93 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 5-0.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(4-fluoro-4-methyl-5,6-dihydro-1H-cyclopenta[c]pyrazol-3-yl)methanol
CID 105434430
3-Methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-ol
CID 66489160
3-Ethyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-ol
CID 66489185
3-Propyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-ol
CID 66489194
3-(2-Aminoethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-ol
CID 83863535
3-(Methylaminomethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-ol
CID 83863537
3-(Aminomethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-ol
CID 83863538
4-(aminomethyl)-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-ol
CID 83905084
4-(aminomethyl)-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-ol
CID 83905564
4-(2-aminoethyl)-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-ol
CID 83905570
4-(Aminomethyl)-1,3-dimethyl-5,6-dihydrocyclopenta[d]pyrazol-4-ol
CID 83906520
4-(Aminomethyl)-2,3-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-ol
CID 83906521

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol?
The IUPAC name of 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol (CID 83905566) is 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol.
What is the SMILES notation for 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol?
The canonical SMILES for 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol is Cc1[nH]nc2c1C(O)(CN)CC2.
What is the InChIKey of 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol?
The InChIKey is MZCYQYFUPLPZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5-7-6(11-10-5)2-3-8(7,12)4-9/h12H,2-4,9H2,1H3,(H,10,11).
What are the key properties of 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol?
4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol has a molecular weight of 167.21 g/mol, XLogP of -0.19, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol is sourced from PubChem (CID 83905566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).