1-(2-oxopentyl)pyrrolidin-2-one

C9H15NO2 — CID 62043134

IUPAC1-(2-oxopentyl)pyrrolidin-2-one
SMILESCCCC(=O)CN1CCCC1=O
InChIInChI=1S/C9H15NO2/c1-2-4-8(11)7-10-6-3-5-9(10)12/h2-7H2,1H3
InChIKeyJIPVKNTYQOKPDT-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.98
Rot. Bonds4

About 1-(2-oxopentyl)pyrrolidin-2-one

1-(2-oxopentyl)pyrrolidin-2-one (PubChem CID 62043134) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 1-(2-oxopentyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-oxopentyl)pyrrolidin-2-one
PubChem CID62043134
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name1-(2-oxopentyl)pyrrolidin-2-one
SMILESCCCC(=O)CN1CCCC1=O
InChIInChI=1S/C9H15NO2/c1-2-4-8(11)7-10-6-3-5-9(10)12/h2-7H2,1H3
InChIKeyJIPVKNTYQOKPDT-UHFFFAOYSA-N
XLogP0.98
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-oxopyrrolidin-1-yl)ethanethioic S-acid
CID 57303794
N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide
CID 167682160
1-(3-methoxy-2-oxopropyl)piperidin-2-one
CID 107507681
1-(2-oxopentyl)-4-propylpiperazine-2,5-dione
CID 79941384
1-dodecylpyrrolidin-2-one
CID 70222371
1-hexylpyrrolidin-2-one
CID 158904818
N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
CID 123515256
nonyl 2-(2-oxopyrrolidin-1-yl)acetate
CID 10778404
2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]-N-propylacetamide
CID 56810104
1-(2-hydroxyiminopropyl)pyrrolidin-2-one
CID 72586532
1-ethylpyrrolidin-2-one;hydrazine
CID 159147234
2-(2-oxopiperidin-1-yl)acetate
CID 18981165

Frequently Asked Questions

What is the IUPAC name of 1-(2-oxopentyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-oxopentyl)pyrrolidin-2-one (CID 62043134) is 1-(2-oxopentyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-oxopentyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-oxopentyl)pyrrolidin-2-one is CCCC(=O)CN1CCCC1=O.
What is the InChIKey of 1-(2-oxopentyl)pyrrolidin-2-one?
The InChIKey is JIPVKNTYQOKPDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-2-4-8(11)7-10-6-3-5-9(10)12/h2-7H2,1H3.
What are the key properties of 1-(2-oxopentyl)pyrrolidin-2-one?
1-(2-oxopentyl)pyrrolidin-2-one has a molecular weight of 169.22 g/mol, XLogP of 0.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-oxopentyl)pyrrolidin-2-one is sourced from PubChem (CID 62043134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).