4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol

C10H17N3O — CID 83907840

IUPAC4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol
SMILESCC(C)c1n[nH]c2c1C(O)(CN)CC2
InChIInChI=1S/C10H17N3O/c1-6(2)9-8-7(12-13-9)3-4-10(8,14)5-11/h6,14H,3-5,11H2,1-2H3,(H,12,13)
InChIKeyGMDPYJZRAQJFLU-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.63
Rot. Bonds2

About 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol

4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol (PubChem CID 83907840) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol.

Molecular Properties

Compound Name4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol
PubChem CID83907840
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol
SMILESCC(C)c1n[nH]c2c1C(O)(CN)CC2
InChIInChI=1S/C10H17N3O/c1-6(2)9-8-7(12-13-9)3-4-10(8,14)5-11/h6,14H,3-5,11H2,1-2H3,(H,12,13)
InChIKeyGMDPYJZRAQJFLU-UHFFFAOYSA-N
XLogP0.63
TPSA74.93 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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-(aminomethyl)-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-ol
CID 83905566
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-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol?
The IUPAC name of 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol (CID 83907840) is 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol.
What is the SMILES notation for 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol?
The canonical SMILES for 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol is CC(C)c1n[nH]c2c1C(O)(CN)CC2.
What is the InChIKey of 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol?
The InChIKey is GMDPYJZRAQJFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-6(2)9-8-7(12-13-9)3-4-10(8,14)5-11/h6,14H,3-5,11H2,1-2H3,(H,12,13).
What are the key properties of 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol?
4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol has a molecular weight of 195.27 g/mol, XLogP of 0.63, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol is sourced from PubChem (CID 83907840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).