N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide

C18H26N2O2 — CID 110314338

IUPACN-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1
InChIInChI=1S/C18H26N2O2/c1-2-3-6-17(21)19-16-10-7-15(8-11-16)9-12-18(22)20-13-4-5-14-20/h7-8,10-11H,2-6,9,12-14H2,1H3,(H,19,21)
InChIKeyYOJILWDJWSFOFY-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.37
Rot. Bonds7

About N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide

N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide (PubChem CID 110314338) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide.

Molecular Properties

Compound NameN-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide
PubChem CID110314338
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1
InChIInChI=1S/C18H26N2O2/c1-2-3-6-17(21)19-16-10-7-15(8-11-16)9-12-18(22)20-13-4-5-14-20/h7-8,10-11H,2-6,9,12-14H2,1H3,(H,19,21)
InChIKeyYOJILWDJWSFOFY-UHFFFAOYSA-N
XLogP3.37
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide
CID 110633755
N-[4-(pyrrolidin-1-ylmethyl)phenyl]pentanamide
CID 3292281
N-(4-butylphenyl)pyrrolidine-1-carboxamide
CID 6467545
2-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)anilino]ethene-1,1,2-tricarbonitrile
CID 168609116
(2S)-2-amino-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide;hydrochloride
CID 119303606
1-(3-hydroxypropyl)-3-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]urea
CID 60577432
N-(4-heptylphenyl)heptanamide
CID 101077737
3-[4-(octanoylamino)phenyl]propanoic acid
CID 81370098
6-oxo-N-phenyl-6-piperidin-1-ylhexanamide
CID 10850910
2-(azepan-1-yl)-N-(4-butylphenyl)-2-oxoacetamide
CID 108502414
trans-(1S,2R)-2-methyl-1-[[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 138028390
N-[4-(chloromethyl)phenyl]pentanamide
CID 86032460

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide?
The IUPAC name of N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide (CID 110314338) is N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide.
What is the SMILES notation for N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide?
The canonical SMILES for N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide is CCCCC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1.
What is the InChIKey of N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide?
The InChIKey is YOJILWDJWSFOFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-2-3-6-17(21)19-16-10-7-15(8-11-16)9-12-18(22)20-13-4-5-14-20/h7-8,10-11H,2-6,9,12-14H2,1H3,(H,19,21).
What are the key properties of N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide?
N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide has a molecular weight of 302.42 g/mol, XLogP of 3.37, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide is sourced from PubChem (CID 110314338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).