7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide

C14H27N3O2 — CID 119671569

IUPAC7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide
SMILESNCCCCCCC(=O)NCCCN1CCCC1=O
InChIInChI=1S/C14H27N3O2/c15-9-4-2-1-3-7-13(18)16-10-6-12-17-11-5-8-14(17)19/h1-12,15H2,(H,16,18)
InChIKeyWMIFQZUUMGGKIA-UHFFFAOYSA-N
MW269.39 g/mol
LogP1.02
Rot. Bonds10

About 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide

7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide (PubChem CID 119671569) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide.

Molecular Properties

Compound Name7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide
PubChem CID119671569
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide
SMILESNCCCCCCC(=O)NCCCN1CCCC1=O
InChIInChI=1S/C14H27N3O2/c15-9-4-2-1-3-7-13(18)16-10-6-12-17-11-5-8-14(17)19/h1-12,15H2,(H,16,18)
InChIKeyWMIFQZUUMGGKIA-UHFFFAOYSA-N
XLogP1.02
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
CID 123515256
1-(4-aminobutyl)pyrrolidin-2-one;hydrochloride
CID 56604167
2-(2-oxopiperidin-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86984731
4-[3-(2-oxopiperidin-1-yl)propanoylamino]butanamide
CID 139517074
2-[2-[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethoxy]ethoxy]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 574581
2-chloro-N-[3-(2-oxoazepan-1-yl)propyl]acetamide
CID 54592450
4-chloro-N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)propylamino]propyl]benzamide
CID 18161251
2-(diethylamino)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86977577
4-[3-(2-oxopiperidin-1-yl)propanoylamino]butanoic acid
CID 139516844
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
6-amino-N-(7-aminoheptyl)hexanamide
CID 56980494
3-(5-chlorothiophen-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
CID 78886193

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide?
The IUPAC name of 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide (CID 119671569) is 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide.
What is the SMILES notation for 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide?
The canonical SMILES for 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide is NCCCCCCC(=O)NCCCN1CCCC1=O.
What is the InChIKey of 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide?
The InChIKey is WMIFQZUUMGGKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c15-9-4-2-1-3-7-13(18)16-10-6-12-17-11-5-8-14(17)19/h1-12,15H2,(H,16,18).
What are the key properties of 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide?
7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide has a molecular weight of 269.39 g/mol, XLogP of 1.02, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide is sourced from PubChem (CID 119671569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).