N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide

C10H18N2O3 — CID 107319131

IUPACN-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide
SMILESO=C1CCC(C(=O)NCCCCCO)N1
InChIInChI=1S/C10H18N2O3/c13-7-3-1-2-6-11-10(15)8-4-5-9(14)12-8/h8,13H,1-7H2,(H,11,15)(H,12,14)
InChIKeyMRLZWQJQWUNSDU-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.46
Rot. Bonds6

About N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide

N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 107319131) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide
PubChem CID107319131
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC NameN-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide
SMILESO=C1CCC(C(=O)NCCCCCO)N1
InChIInChI=1S/C10H18N2O3/c13-7-3-1-2-6-11-10(15)8-4-5-9(14)12-8/h8,13H,1-7H2,(H,11,15)(H,12,14)
InChIKeyMRLZWQJQWUNSDU-UHFFFAOYSA-N
XLogP-0.46
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-N-(4-hydroxybutyl)-5-oxopyrrolidine-2-carboxamide
CID 107168306
(2S)-N-(3-hydroxypropyl)-5-oxopyrrolidine-2-carboxamide
CID 103799933
(2R)-N-(5-aminopentyl)-5-oxopyrrolidine-2-carboxamide
CID 170277204
(2S)-N-(3-aminopropyl)-5-oxopyrrolidine-2-carboxamide
CID 103805016
5-oxo-N-[2-[2-[(5-oxopyrrolidine-2-carbonyl)amino]ethylamino]ethyl]pyrrolidine-2-carboxamide
CID 155810723
(2S)-N-[2-(methylamino)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 94537622
N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide
CID 110689650
N-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide
CID 110689693
N-(6-hydroxyhexyl)-5-oxopiperazine-2-carboxamide
CID 107842610
5-oxo-N-[2-oxo-2-[2-[[2-[(5-oxopyrrolidine-2-carbonyl)amino]acetyl]amino]ethylamino]ethyl]pyrrolidine-2-carboxamide
CID 19751769
N-(cyanomethyl)-5-oxopyrrolidine-2-carboxamide
CID 515622
2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]acetate
CID 11902929

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide (CID 107319131) is N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide is O=C1CCC(C(=O)NCCCCCO)N1.
What is the InChIKey of N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is MRLZWQJQWUNSDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c13-7-3-1-2-6-11-10(15)8-4-5-9(14)12-8/h8,13H,1-7H2,(H,11,15)(H,12,14).
What are the key properties of N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide?
N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 214.26 g/mol, XLogP of -0.46, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxypentyl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 107319131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).