1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide

C14H25N3O3 — CID 81083197

IUPAC1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide
SMILESCOCCCC(N)C(=O)N1CCCC1C(=O)NC1CC1
InChIInChI=1S/C14H25N3O3/c1-20-9-3-4-11(15)14(19)17-8-2-5-12(17)13(18)16-10-6-7-10/h10-12H,2-9,15H2,1H3,(H,16,18)
InChIKeyZIHPRBRFPOGNEQ-UHFFFAOYSA-N
MW283.37 g/mol
LogP0.01
Rot. Bonds7

About 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide

1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide (PubChem CID 81083197) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide
PubChem CID81083197
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide
SMILESCOCCCC(N)C(=O)N1CCCC1C(=O)NC1CC1
InChIInChI=1S/C14H25N3O3/c1-20-9-3-4-11(15)14(19)17-8-2-5-12(17)13(18)16-10-6-7-10/h10-12H,2-9,15H2,1H3,(H,16,18)
InChIKeyZIHPRBRFPOGNEQ-UHFFFAOYSA-N
XLogP0.01
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-amino-5-methoxypentanoyl)-N-methylpyrrolidine-2-carboxamide
CID 81089238
1-(2-aminohexanoyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 54870726
1-[(2S)-2-aminobutanoyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
CID 119291895
1-(2-amino-4-methoxybutanoyl)pyrrolidine-2-carboxamide
CID 62473351
1-(6-amino-2-methylheptanoyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 65290967
1-[(2R)-2-aminopropanoyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
CID 119291892
1-[(2S)-2-amino-3-methylbutanoyl]-N-cyclopropylpyrrolidine-2-carboxamide
CID 61163718
2-amino-1-(2-cyclohexylpyrrolidin-1-yl)-5-methoxypentan-1-one
CID 81089538
N-cyclopropyl-1-(2-methoxyacetyl)pyrrolidine-2-carboxamide
CID 60733576
1-(2-amino-5-methoxypentanoyl)-3-methylpiperidine-2-carboxylic acid
CID 107068899
2-amino-1-[2-(3-hydroxypropyl)pyrrolidin-1-yl]-5-methoxypentan-1-one
CID 81088440
(2S)-1-[(2S)-2-aminopropanoyl]-N-cyclopentylpyrrolidine-2-carboxamide
CID 54355584

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide (CID 81083197) is 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide is COCCCC(N)C(=O)N1CCCC1C(=O)NC1CC1.
What is the InChIKey of 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide?
The InChIKey is ZIHPRBRFPOGNEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-20-9-3-4-11(15)14(19)17-8-2-5-12(17)13(18)16-10-6-7-10/h10-12H,2-9,15H2,1H3,(H,16,18).
What are the key properties of 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide?
1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide has a molecular weight of 283.37 g/mol, XLogP of 0.01, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-5-methoxypentanoyl)-N-cyclopropylpyrrolidine-2-carboxamide is sourced from PubChem (CID 81083197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).