(4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol

C8H13N3O — CID 112714380

IUPAC(4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol
SMILESCC1Cc2[nH]ncc2C1(N)CO
InChIInChI=1S/C8H13N3O/c1-5-2-7-6(3-10-11-7)8(5,9)4-12/h3,5,12H,2,4,9H2,1H3,(H,10,11)
InChIKeyOBWDLJASSYWJBI-UHFFFAOYSA-N
MW167.21 g/mol
LogP-0.25
Rot. Bonds1

About (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol

(4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol (PubChem CID 112714380) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol.

Molecular Properties

Compound Name(4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol
PubChem CID112714380
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name(4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol
SMILESCC1Cc2[nH]ncc2C1(N)CO
InChIInChI=1S/C8H13N3O/c1-5-2-7-6(3-10-11-7)8(5,9)4-12/h3,5,12H,2,4,9H2,1H3,(H,10,11)
InChIKeyOBWDLJASSYWJBI-UHFFFAOYSA-N
XLogP-0.25
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 ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-propan-2-yl-1H-pyrazol-5-yl)butan-1-ol
CID 168139739
2-(5-cyclopentyl-1H-pyrazol-4-yl)ethan-1-ol
CID 83674669
2-(5-isopropyl-1H-pyrazol-4-yl)ethan-1-ol
CID 83674672
(4-amino-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol
CID 83905085
(4-amino-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-yl)methanol
CID 83905572
(4-Amino-2-methyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol
CID 83905574
(4-Amino-1-methyl-5,6-dihydrocyclopenta[d]pyrazol-4-yl)methanol
CID 83905575
(4-amino-3-cyclopropyl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-yl)methanol
CID 83907545
(4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazol-4-yl)methanol
CID 83907845
4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazole-4-carboxylic acid
CID 112714721
(4-amino-3,5-dimethyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-yl)methanol
CID 112714743
(4-Amino-2,5-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)methanol
CID 112714745

Frequently Asked Questions

What is the IUPAC name of (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol?
The IUPAC name of (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol (CID 112714380) is (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol.
What is the SMILES notation for (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol?
The canonical SMILES for (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol is CC1Cc2[nH]ncc2C1(N)CO.
What is the InChIKey of (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol?
The InChIKey is OBWDLJASSYWJBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5-2-7-6(3-10-11-7)8(5,9)4-12/h3,5,12H,2,4,9H2,1H3,(H,10,11).
What are the key properties of (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol?
(4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol has a molecular weight of 167.21 g/mol, XLogP of -0.25, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-5-methyl-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)methanol is sourced from PubChem (CID 112714380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).