N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide

C13H24N2O2 — CID 110736860

IUPACN-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide
SMILESCCCCC(=O)NC1CC(=O)N(C(C)(C)C)C1
InChIInChI=1S/C13H24N2O2/c1-5-6-7-11(16)14-10-8-12(17)15(9-10)13(2,3)4/h10H,5-9H2,1-4H3,(H,14,16)
InChIKeySLYCVVHQINRNPO-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.69
Rot. Bonds4

About N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide

N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide (PubChem CID 110736860) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide.

Molecular Properties

Compound NameN-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide
PubChem CID110736860
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide
SMILESCCCCC(=O)NC1CC(=O)N(C(C)(C)C)C1
InChIInChI=1S/C13H24N2O2/c1-5-6-7-11(16)14-10-8-12(17)15(9-10)13(2,3)4/h10H,5-9H2,1-4H3,(H,14,16)
InChIKeySLYCVVHQINRNPO-UHFFFAOYSA-N
XLogP1.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-(1-tert-butyl-5-oxopyrrolidin-3-yl)butanamide
CID 119343413
4-amino-N-(1-tert-butyl-5-oxopyrrolidin-3-yl)butanamide;hydrochloride
CID 119343412
1-butyl-3-(1-tert-butyl-5-oxopyrrolidin-3-yl)-1-methylurea
CID 108876218
N-(1-tert-butyl-5-oxopyrrolidin-3-yl)-3-phenylpropanamide
CID 110736896
1-butyl-3-(1-tert-butyl-5-oxopyrrolidin-3-yl)-1-propylurea
CID 108876154
N-(1-tert-butyl-5-oxopyrrolidin-3-yl)-2-(cyclopropylmethylamino)acetamide
CID 119818280
N-(1-tert-butyl-5-oxopyrrolidin-3-yl)-3-(4-fluorophenyl)propanamide
CID 110736931
N-(1-tert-butyl-5-oxopyrrolidin-3-yl)-2-(4-methylphenyl)acetamide
CID 110736936
N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)pentadecanamide
CID 167356963
1-(1-tert-butyl-5-oxopyrrolidin-3-yl)-3-cyclohexylurea
CID 110749319
1-(1-tert-butyl-5-oxopyrrolidin-3-yl)-3-(2-chloroethyl)urea
CID 108876104
N-(1-tert-butyl-5-oxopyrrolidin-3-yl)-2-(4-fluorophenoxy)acetamide
CID 110736947

Frequently Asked Questions

What is the IUPAC name of N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide?
The IUPAC name of N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide (CID 110736860) is N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide.
What is the SMILES notation for N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide?
The canonical SMILES for N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide is CCCCC(=O)NC1CC(=O)N(C(C)(C)C)C1.
What is the InChIKey of N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide?
The InChIKey is SLYCVVHQINRNPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-5-6-7-11(16)14-10-8-12(17)15(9-10)13(2,3)4/h10H,5-9H2,1-4H3,(H,14,16).
What are the key properties of N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide?
N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide has a molecular weight of 240.35 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-tert-butyl-5-oxopyrrolidin-3-yl)pentanamide is sourced from PubChem (CID 110736860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).