N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide

C13H27N3O — CID 103188746

IUPACN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide
SMILESCCN(C(=O)CC1CCNC1)C(C)CN(C)C
InChIInChI=1S/C13H27N3O/c1-5-16(11(2)10-15(3)4)13(17)8-12-6-7-14-9-12/h11-12,14H,5-10H2,1-4H3
InChIKeyLQPGVVPMLLUOJY-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.78
Rot. Bonds6

About N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide

N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide (PubChem CID 103188746) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide
PubChem CID103188746
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide
SMILESCCN(C(=O)CC1CCNC1)C(C)CN(C)C
InChIInChI=1S/C13H27N3O/c1-5-16(11(2)10-15(3)4)13(17)8-12-6-7-14-9-12/h11-12,14H,5-10H2,1-4H3
InChIKeyLQPGVVPMLLUOJY-UHFFFAOYSA-N
XLogP0.78
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)propan-2-yl]-N-ethylacetamide
CID 103188749
N-methyl-N-(4-methylpentyl)-2-pyrrolidin-3-ylacetamide
CID 115160396
N-(2-methoxyethyl)-N-propan-2-yl-2-pyrrolidin-3-ylacetamide
CID 82949070
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-morpholin-3-ylacetamide
CID 103188714
2-piperidin-4-yl-N-propan-2-yl-N-propylacetamide
CID 43269799
N-[1-(dimethylamino)propan-2-yl]-N,4-diethylpiperidine-2-carboxamide
CID 103188614
N-methyl-N-(2-methylpropyl)-2-piperidin-3-ylacetamide
CID 62690193
N-methyl-2-piperidin-4-yl-N-propan-2-ylacetamide
CID 24690049
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-4-ylacetamide
CID 61029614
N-butan-2-yl-N-butyl-2-piperidin-4-ylacetamide
CID 61028847
N-methyl-N-(4-propan-2-ylphenyl)-2-pyrrolidin-3-ylacetamide
CID 115160298
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide
CID 103188683

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide?
The IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide (CID 103188746) is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide.
What is the SMILES notation for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide?
The canonical SMILES for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide is CCN(C(=O)CC1CCNC1)C(C)CN(C)C.
What is the InChIKey of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide?
The InChIKey is LQPGVVPMLLUOJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-5-16(11(2)10-15(3)4)13(17)8-12-6-7-14-9-12/h11-12,14H,5-10H2,1-4H3.
What are the key properties of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide?
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide has a molecular weight of 241.38 g/mol, XLogP of 0.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 103188746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).