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

C8H12N2O — CID 68792181

IUPAC(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol
SMILESCn1nc(CO)c2c1CCC2
InChIInChI=1S/C8H12N2O/c1-10-8-4-2-3-6(8)7(5-11)9-10/h11H,2-5H2,1H3
InChIKeyGXTQDTXWYDZHAP-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.40
Rot. Bonds1

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

(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol (PubChem CID 68792181) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol.

Molecular Properties

Compound Name(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol
PubChem CID68792181
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol
SMILESCn1nc(CO)c2c1CCC2
InChIInChI=1S/C8H12N2O/c1-10-8-4-2-3-6(8)7(5-11)9-10/h11H,2-5H2,1H3
InChIKeyGXTQDTXWYDZHAP-UHFFFAOYSA-N
XLogP0.40
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol?
The IUPAC name of (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol (CID 68792181) is (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol.
What is the SMILES notation for (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol?
The canonical SMILES for (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol is Cn1nc(CO)c2c1CCC2.
What is the InChIKey of (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol?
The InChIKey is GXTQDTXWYDZHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-10-8-4-2-3-6(8)7(5-11)9-10/h11H,2-5H2,1H3.
What are the key properties of (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol?
(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol has a molecular weight of 152.20 g/mol, XLogP of 0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanol is sourced from PubChem (CID 68792181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).