1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde

C11H17NO2 — CID 88907638

IUPAC1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde
SMILESCCC1(C(=O)N2CCCC2C=O)CC1
InChIInChI=1S/C11H17NO2/c1-2-11(5-6-11)10(14)12-7-3-4-9(12)8-13/h8-9H,2-7H2,1H3
InChIKeyWEYUHOLNEXKWLK-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.37
Rot. Bonds3

About 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde

1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde (PubChem CID 88907638) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde.

Molecular Properties

Compound Name1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde
PubChem CID88907638
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde
SMILESCCC1(C(=O)N2CCCC2C=O)CC1
InChIInChI=1S/C11H17NO2/c1-2-11(5-6-11)10(14)12-7-3-4-9(12)8-13/h8-9H,2-7H2,1H3
InChIKeyWEYUHOLNEXKWLK-UHFFFAOYSA-N
XLogP1.37
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde 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-butanoylpyrrolidine-2-carbaldehyde
CID 19783440
methyl 1-(4-ethylpiperidine-4-carbonyl)pyrrolidine-2-carboxylate
CID 63128448
1-(2,2-dimethylbutanoyl)pyrrolidine-2-carbaldehyde
CID 88907637
(2R)-1-(4-ethylpiperidine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 78925392
1-(2-methylsulfanylacetyl)pyrrolidine-2-carbaldehyde
CID 14192042
(2S)-1-[(E)-but-2-enoyl]pyrrolidine-2-carbaldehyde
CID 101071954
ethane;1-propanoylpyrrolidine-2-carbaldehyde;prop-1-ene
CID 142269082
[2-(aminomethyl)azepan-1-yl]-(1-ethylcyclopentyl)methanone
CID 116639879
1-tetradecanoylpyrrolidine-2-carbaldehyde
CID 139473494
1-(cyclohexanecarbonyl)pyrrolidine-2-carbaldehyde
CID 146358075
butyl 2-formylpyrrolidine-1-carboxylate
CID 54059986
2-[1-(3-ethylpyrrolidine-3-carbonyl)pyrrolidin-2-yl]acetic acid
CID 55164770

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde?
The IUPAC name of 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde (CID 88907638) is 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde.
What is the SMILES notation for 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde?
The canonical SMILES for 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde is CCC1(C(=O)N2CCCC2C=O)CC1.
What is the InChIKey of 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde?
The InChIKey is WEYUHOLNEXKWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-2-11(5-6-11)10(14)12-7-3-4-9(12)8-13/h8-9H,2-7H2,1H3.
What are the key properties of 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde?
1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde has a molecular weight of 195.26 g/mol, XLogP of 1.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylcyclopropanecarbonyl)pyrrolidine-2-carbaldehyde is sourced from PubChem (CID 88907638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).