2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide

C17H28N4O5 — CID 155944628

IUPAC2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide
SMILESNC(=O)CCC(NC(=O)CCC1CCCC1)C(=O)NCC1CNC(=O)O1
InChIInChI=1S/C17H28N4O5/c18-14(22)7-6-13(16(24)19-9-12-10-20-17(25)26-12)21-15(23)8-5-11-3-1-2-4-11/h11-13H,1-10H2,(H2,18,22)(H,19,24)(H,20,25)(H,21,23)
InChIKeyRJZDVZIJAOLINQ-UHFFFAOYSA-N
MW368.43 g/mol
LogP-0.07
Rot. Bonds10

About 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide

2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide (PubChem CID 155944628) has the molecular formula C17H28N4O5 and a molecular weight of 368.43 g/mol. Its IUPAC name is 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide.

Molecular Properties

Compound Name2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide
PubChem CID155944628
Molecular FormulaC17H28N4O5
Molecular Weight368.43 g/mol
Exact Mass368.21
IUPAC Name2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide
SMILESNC(=O)CCC(NC(=O)CCC1CCCC1)C(=O)NCC1CNC(=O)O1
InChIInChI=1S/C17H28N4O5/c18-14(22)7-6-13(16(24)19-9-12-10-20-17(25)26-12)21-15(23)8-5-11-3-1-2-4-11/h11-13H,1-10H2,(H2,18,22)(H,19,24)(H,20,25)(H,21,23)
InChIKeyRJZDVZIJAOLINQ-UHFFFAOYSA-N
XLogP-0.07
TPSA139.62 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 5-0.07
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide?
The IUPAC name of 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide (CID 155944628) is 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide.
What is the SMILES notation for 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide?
The canonical SMILES for 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide is NC(=O)CCC(NC(=O)CCC1CCCC1)C(=O)NCC1CNC(=O)O1.
What is the InChIKey of 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide?
The InChIKey is RJZDVZIJAOLINQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O5/c18-14(22)7-6-13(16(24)19-9-12-10-20-17(25)26-12)21-15(23)8-5-11-3-1-2-4-11/h11-13H,1-10H2,(H2,18,22)(H,19,24)(H,20,25)(H,21,23).
What are the key properties of 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide?
2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide has a molecular weight of 368.43 g/mol, XLogP of -0.07, 10 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopentylpropanoylamino)-N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]pentanediamide is sourced from PubChem (CID 155944628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).