2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide

C10H20N2O — CID 126990123

IUPAC2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide
SMILESCCC1CCN(C(C)C(=O)NC)C1
InChIInChI=1S/C10H20N2O/c1-4-9-5-6-12(7-9)8(2)10(13)11-3/h8-9H,4-7H2,1-3H3,(H,11,13)
InChIKeyILSCOZODNMUHDZ-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.85
Rot. Bonds3

About 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide

2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide (PubChem CID 126990123) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide.

Molecular Properties

Compound Name2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide
PubChem CID126990123
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide
SMILESCCC1CCN(C(C)C(=O)NC)C1
InChIInChI=1S/C10H20N2O/c1-4-9-5-6-12(7-9)8(2)10(13)11-3/h8-9H,4-7H2,1-3H3,(H,11,13)
InChIKeyILSCOZODNMUHDZ-UHFFFAOYSA-N
XLogP0.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-methylpropanamide
CID 66291565
2-[3-(hydroxymethyl)pyrrolidin-1-yl]-N-propan-2-ylpropanamide
CID 62370861
N-butyl-2-[3-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 62370682
tert-butyl 2-(3-ethylpyrrolidin-1-yl)propanoate
CID 115688615
2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-methylpropanamide
CID 115314435
2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-methylpropanamide
CID 114961414
(2R)-2-[4,7-bis[(2R)-1-(methylamino)-1-oxopropan-2-yl]-1,4,7-triazonan-1-yl]-N-methylpropanamide
CID 177439425
2-[3-(2-aminoethyl)pyrrolidin-1-yl]-N-ethylpropanamide
CID 114802683
2-[3-(2-aminoethyl)pyrrolidin-1-yl]-N-propylpropanamide
CID 114802599
N-cyclopentyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]propanamide;hydrochloride
CID 119922095
methyl (3S)-1-[1-(methylamino)-1-oxopropan-2-yl]piperidine-3-carboxylate
CID 79037827
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 112630269

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide?
The IUPAC name of 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide (CID 126990123) is 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide.
What is the SMILES notation for 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide?
The canonical SMILES for 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide is CCC1CCN(C(C)C(=O)NC)C1.
What is the InChIKey of 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide?
The InChIKey is ILSCOZODNMUHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-4-9-5-6-12(7-9)8(2)10(13)11-3/h8-9H,4-7H2,1-3H3,(H,11,13).
What are the key properties of 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide?
2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide has a molecular weight of 184.28 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide is sourced from PubChem (CID 126990123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).