1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide

C14H27N3O2 — CID 119305878

IUPAC1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide
SMILESCCCC(N)C(=O)N1CCCC1C(=O)N(CC)CC
InChIInChI=1S/C14H27N3O2/c1-4-8-11(15)13(18)17-10-7-9-12(17)14(19)16(5-2)6-3/h11-12H,4-10,15H2,1-3H3
InChIKeyGSBBXIZNLZWALW-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.97
Rot. Bonds6

About 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide

1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide (PubChem CID 119305878) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide
PubChem CID119305878
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide
SMILESCCCC(N)C(=O)N1CCCC1C(=O)N(CC)CC
InChIInChI=1S/C14H27N3O2/c1-4-8-11(15)13(18)17-10-7-9-12(17)14(19)16(5-2)6-3/h11-12H,4-10,15H2,1-3H3
InChIKeyGSBBXIZNLZWALW-UHFFFAOYSA-N
XLogP0.97
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-aminopentanoyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 43650356
1-(2-aminoacetyl)-N,N-diethylpyrrolidine-2-carboxamide;hydrochloride
CID 119305869
[1-(2-aminopentanoyl)pyrrolidin-2-yl]boronic acid
CID 59336843
1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-aminopentan-1-one
CID 102726243
1-(4-aminobutanoyl)-N,N-diethylpyrrolidine-2-carboxamide
CID 119305882
2-amino-1-(2-ethylpiperidin-1-yl)pentan-1-one;hydrochloride
CID 119261722
1-(2-aminohexanoyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 54870726
N,N-diethyl-1-methylpyrrolidine-2-carboxamide
CID 21365849
2-amino-1-(2-propan-2-ylpiperidin-1-yl)pentan-1-one;hydrochloride
CID 119326462
(2S)-1-[(2S)-2-amino-4-carboxybutanoyl]pyrrolidine-2-carboxylic acid
CID 11218768
4-[(2R)-2-aminopentanoyl]thiomorpholine-3-carboxylic acid
CID 107570416
1-(2-amino-4-methoxybutanoyl)pyrrolidine-2-carboxamide
CID 62473351

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide (CID 119305878) is 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide is CCCC(N)C(=O)N1CCCC1C(=O)N(CC)CC.
What is the InChIKey of 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide?
The InChIKey is GSBBXIZNLZWALW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-4-8-11(15)13(18)17-10-7-9-12(17)14(19)16(5-2)6-3/h11-12H,4-10,15H2,1-3H3.
What are the key properties of 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide?
1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminopentanoyl)-N,N-diethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 119305878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).