1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide

C11H21N3O2 — CID 104683570

IUPAC1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide
SMILESCC(CCCN)C(=O)N1CCCC1C(N)=O
InChIInChI=1S/C11H21N3O2/c1-8(4-2-6-12)11(16)14-7-3-5-9(14)10(13)15/h8-9H,2-7,12H2,1H3,(H2,13,15)
InChIKeyWYUAYLNMNPXWCO-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.16
Rot. Bonds5

About 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide

1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide (PubChem CID 104683570) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide
PubChem CID104683570
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide
SMILESCC(CCCN)C(=O)N1CCCC1C(N)=O
InChIInChI=1S/C11H21N3O2/c1-8(4-2-6-12)11(16)14-7-3-5-9(14)10(13)15/h8-9H,2-7,12H2,1H3,(H2,13,15)
InChIKeyWYUAYLNMNPXWCO-UHFFFAOYSA-N
XLogP-0.16
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-amino-2-methylpentanoyl)morpholine-3-carboxamide
CID 104685527
1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-5-amino-2-methylpentan-1-one
CID 104685219
N'-hydroxy-1-(2-methylhexanoyl)pyrrolidine-2-carboximidamide
CID 114246956
5-amino-1-[2-(3-hydroxypropyl)pyrrolidin-1-yl]-2-methylpentan-1-one
CID 104684988
(2S)-1-[(2S)-2-[[(1R)-10-amino-1-carboxydecyl]amino]propanoyl]pyrrolidine-2-carboxylic acid
CID 15927715
tert-butyl N-[(2S)-6-amino-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxohexan-2-yl]carbamate
CID 54377950
5-amino-2-methyl-1-(3-methylpiperidin-1-yl)pentan-1-one
CID 104683408
(2S)-1-(2-amino-3-methylbutanoyl)pyrrolidine-2-carboxamide
CID 177223848
1-[(2S)-2-amino-3-methylbutanoyl]pyrrolidine-2-carboxamide
CID 61148979
5-amino-2-methyl-1-(2-phenylpyrrolidin-1-yl)pentan-1-one
CID 104683709
(2S)-1-[(2R)-2-methyl-4-phenoxybutanoyl]pyrrolidine-2-carboxamide
CID 95905191
1-(2-methylpropanoyl)piperidine-2-carboxamide
CID 60717227

Frequently Asked Questions

What is the IUPAC name of 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide (CID 104683570) is 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide is CC(CCCN)C(=O)N1CCCC1C(N)=O.
What is the InChIKey of 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide?
The InChIKey is WYUAYLNMNPXWCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8(4-2-6-12)11(16)14-7-3-5-9(14)10(13)15/h8-9H,2-7,12H2,1H3,(H2,13,15).
What are the key properties of 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide?
1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide has a molecular weight of 227.31 g/mol, XLogP of -0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-amino-2-methylpentanoyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 104683570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).