1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone

C10H15N3O2 — CID 62349582

IUPAC1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
SMILESO=C(Cn1cccn1)N1CCC(CO)C1
InChIInChI=1S/C10H15N3O2/c14-8-9-2-5-12(6-9)10(15)7-13-4-1-3-11-13/h1,3-4,9,14H,2,5-8H2
InChIKeyRLQUKEXWALGHLT-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.28
Rot. Bonds3

About 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone

1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone (PubChem CID 62349582) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone.

Molecular Properties

Compound Name1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
PubChem CID62349582
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
SMILESO=C(Cn1cccn1)N1CCC(CO)C1
InChIInChI=1S/C10H15N3O2/c14-8-9-2-5-12(6-9)10(15)7-13-4-1-3-11-13/h1,3-4,9,14H,2,5-8H2
InChIKeyRLQUKEXWALGHLT-UHFFFAOYSA-N
XLogP-0.28
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-(methylaminomethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
CID 63263322
1-(3-aminopiperidin-1-yl)-2-pyrazol-1-ylethanone;dihydrochloride
CID 119380216
1-[3-(azepane-1-carbonyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
CID 110246532
1-(4-amino-3-methylpiperidin-1-yl)-2-pyrazol-1-ylethanone;dihydrochloride
CID 119592480
1-(3-hydroxyazetidin-1-yl)-2-pyrazol-1-ylethanone
CID 63106745
1-piperazin-1-yl-2-pyrazol-1-ylethanone
CID 23070038
1-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]-2-pyrazol-1-ylethanone
CID 56822661
2-pyrazol-1-yl-1-[(3S)-3-(1H-pyrazol-5-ylmethyl)piperidin-1-yl]ethanone
CID 124968736
[3-(hydroxymethyl)pyrrolidin-1-yl]-[5-(pyrazol-1-ylmethyl)furan-2-yl]methanone
CID 62372378
1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide
CID 63573929
1-[(3R)-3-aminopyrrolidin-1-yl]-3-pyrazol-1-ylpropan-1-one;dihydrochloride
CID 119410423
1-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
CID 61410629

Frequently Asked Questions

What is the IUPAC name of 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone?
The IUPAC name of 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone (CID 62349582) is 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone.
What is the SMILES notation for 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone?
The canonical SMILES for 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone is O=C(Cn1cccn1)N1CCC(CO)C1.
What is the InChIKey of 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone?
The InChIKey is RLQUKEXWALGHLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c14-8-9-2-5-12(6-9)10(15)7-13-4-1-3-11-13/h1,3-4,9,14H,2,5-8H2.
What are the key properties of 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone?
1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone has a molecular weight of 209.25 g/mol, XLogP of -0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone is sourced from PubChem (CID 62349582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).