[1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone

C10H17NO2 — CID 116921208

IUPAC[1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone
SMILESCN1CCC(C(=O)C2(CO)CC2)C1
InChIInChI=1S/C10H17NO2/c1-11-5-2-8(6-11)9(13)10(7-12)3-4-10/h8,12H,2-7H2,1H3
InChIKeySXSRQXDETICVMT-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.28
Rot. Bonds3

About [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone

[1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone (PubChem CID 116921208) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone.

Molecular Properties

Compound Name[1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone
PubChem CID116921208
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name[1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone
SMILESCN1CCC(C(=O)C2(CO)CC2)C1
InChIInChI=1S/C10H17NO2/c1-11-5-2-8(6-11)9(13)10(7-12)3-4-10/h8,12H,2-7H2,1H3
InChIKeySXSRQXDETICVMT-UHFFFAOYSA-N
XLogP0.28
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone?
The IUPAC name of [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone (CID 116921208) is [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone.
What is the SMILES notation for [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone?
The canonical SMILES for [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone is CN1CCC(C(=O)C2(CO)CC2)C1.
What is the InChIKey of [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone?
The InChIKey is SXSRQXDETICVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-11-5-2-8(6-11)9(13)10(7-12)3-4-10/h8,12H,2-7H2,1H3.
What are the key properties of [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone?
[1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone has a molecular weight of 183.25 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(hydroxymethyl)cyclopropyl]-(1-methylpyrrolidin-3-yl)methanone is sourced from PubChem (CID 116921208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).