N-(2-ethoxyethyl)pyrrolidine-2-carboxamide

C9H18N2O2 — CID 43591374

IUPACN-(2-ethoxyethyl)pyrrolidine-2-carboxamide
SMILESCCOCCNC(=O)C1CCCN1
InChIInChI=1S/C9H18N2O2/c1-2-13-7-6-11-9(12)8-4-3-5-10-8/h8,10H,2-7H2,1H3,(H,11,12)
InChIKeyCZFALGSJBUMYTN-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.11
Rot. Bonds5

About N-(2-ethoxyethyl)pyrrolidine-2-carboxamide

N-(2-ethoxyethyl)pyrrolidine-2-carboxamide (PubChem CID 43591374) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-(2-ethoxyethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)pyrrolidine-2-carboxamide
PubChem CID43591374
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-(2-ethoxyethyl)pyrrolidine-2-carboxamide
SMILESCCOCCNC(=O)C1CCCN1
InChIInChI=1S/C9H18N2O2/c1-2-13-7-6-11-9(12)8-4-3-5-10-8/h8,10H,2-7H2,1H3,(H,11,12)
InChIKeyCZFALGSJBUMYTN-UHFFFAOYSA-N
XLogP-0.11
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-ethoxyethyl)piperidine-2-carboxamide;hydrochloride
CID 119280657
N-(3-ethoxypropyl)azepane-2-carboxamide
CID 64562798
N-(3-ethoxypropyl)azocane-2-carboxamide
CID 114240040
(2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide
CID 104901055
N-propylpyrrolidine-2-carboxamide
CID 4984185
ethyl 3-[[(2R)-pyrrolidine-2-carbonyl]amino]propanoate
CID 103794893
(2S)-N-butylpyrrolidine-2-carboxamide
CID 22691332
N-[4-(2-methoxyethoxy)butyl]pyrrolidine-2-carboxamide
CID 115626529
ethyl 4-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoate;hydrochloride
CID 119290932
(2R)-N-ethylpyrrolidine-2-carboxamide;molecular hydrogen
CID 178045420
N-(2-ethoxyethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119280656
(2S)-N-(3-hydroxy-4-methoxybutyl)pyrrolidine-2-carboxamide
CID 106247580

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(2-ethoxyethyl)pyrrolidine-2-carboxamide (CID 43591374) is N-(2-ethoxyethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-ethoxyethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-ethoxyethyl)pyrrolidine-2-carboxamide is CCOCCNC(=O)C1CCCN1.
What is the InChIKey of N-(2-ethoxyethyl)pyrrolidine-2-carboxamide?
The InChIKey is CZFALGSJBUMYTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-2-13-7-6-11-9(12)8-4-3-5-10-8/h8,10H,2-7H2,1H3,(H,11,12).
What are the key properties of N-(2-ethoxyethyl)pyrrolidine-2-carboxamide?
N-(2-ethoxyethyl)pyrrolidine-2-carboxamide has a molecular weight of 186.25 g/mol, XLogP of -0.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 43591374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).