N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide

C13H25N3O2 — CID 131892803

IUPACN-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide
SMILESCC(CCC(=O)NCC(=O)N(C)C)N1CCCC1
InChIInChI=1S/C13H25N3O2/c1-11(16-8-4-5-9-16)6-7-12(17)14-10-13(18)15(2)3/h11H,4-10H2,1-3H3,(H,14,17)
InChIKeyRIDQWPSNZKPKAS-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.46
Rot. Bonds6

About N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide

N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide (PubChem CID 131892803) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide
PubChem CID131892803
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide
SMILESCC(CCC(=O)NCC(=O)N(C)C)N1CCCC1
InChIInChI=1S/C13H25N3O2/c1-11(16-8-4-5-9-16)6-7-12(17)14-10-13(18)15(2)3/h11H,4-10H2,1-3H3,(H,14,17)
InChIKeyRIDQWPSNZKPKAS-UHFFFAOYSA-N
XLogP0.46
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-5-[[[(4S)-4-pyrrolidin-1-ylpentanoyl]amino]methyl]furan-2-carboxamide
CID 125166646
N-[2-(dimethylamino)-2-oxoethyl]-3-hydroxypropanamide
CID 20719167
N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]-4-pyrrolidin-1-ylpentanamide
CID 136607695
ethyl 4-piperidin-1-ylpentanoate
CID 67188448
(4R)-4-pyrrolidin-1-yl-N-[3-(1,3-thiazol-2-yl)propyl]pentanamide
CID 126452069
(4R)-N-[(5-methyl-1H-imidazol-4-yl)methyl]-4-pyrrolidin-1-ylpentanamide
CID 126435440
5-bromo-N-[2-(dimethylamino)-2-oxoethyl]pentanamide
CID 107907997
5-bromo-N-(2-pyrrolidin-1-ylpropyl)pentanamide
CID 107910399
N-[(2-chlorophenyl)methyl]-N-methyl-4-pyrrolidin-1-ylpentanamide
CID 119066296
N,N-dimethyl-2-[[N-(3-piperidin-1-ylbutyl)-N'-[[3-(trifluoromethyl)phenyl]methyl]carbamimidoyl]amino]acetamide;hydroiodide
CID 110035748
3-(ethylamino)-N-(2-piperidin-1-ylpropyl)propanamide
CID 62836646
4-(1,4-thiazepan-4-yl)pentanehydrazide
CID 63578775

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide (CID 131892803) is N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide is CC(CCC(=O)NCC(=O)N(C)C)N1CCCC1.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide?
The InChIKey is RIDQWPSNZKPKAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-11(16-8-4-5-9-16)6-7-12(17)14-10-13(18)15(2)3/h11H,4-10H2,1-3H3,(H,14,17).
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide?
N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide has a molecular weight of 255.36 g/mol, XLogP of 0.46, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide is sourced from PubChem (CID 131892803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).