5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide

C18H25N3O4S — CID 20630720

IUPAC5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide
SMILESCC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(-c2cnco2)cc1
InChIInChI=1S/C18H25N3O4S/c1-18(2,3)26(23,24)20-11-5-4-6-17(22)21-15-9-7-14(8-10-15)16-12-19-13-25-16/h7-10,12-13,20H,4-6,11H2,1-3H3,(H,21,22)
InChIKeyFDZDJCXYKJXUAU-UHFFFAOYSA-N
MW379.48 g/mol
LogP3.17
Rot. Bonds8

About 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide

5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide (PubChem CID 20630720) has the molecular formula C18H25N3O4S and a molecular weight of 379.48 g/mol. Its IUPAC name is 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide.

Molecular Properties

Compound Name5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide
PubChem CID20630720
Molecular FormulaC18H25N3O4S
Molecular Weight379.48 g/mol
Exact Mass379.16
IUPAC Name5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide
SMILESCC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(-c2cnco2)cc1
InChIInChI=1S/C18H25N3O4S/c1-18(2,3)26(23,24)20-11-5-4-6-17(22)21-15-9-7-14(8-10-15)16-12-19-13-25-16/h7-10,12-13,20H,4-6,11H2,1-3H3,(H,21,22)
InChIKeyFDZDJCXYKJXUAU-UHFFFAOYSA-N
XLogP3.17
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.48
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(1,3-oxazol-5-yl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide
CID 20629196
6-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 60927435
5-(tert-butylsulfonylamino)-N-[4-(2,2-dimethylpropanoylamino)phenyl]pentanamide
CID 58958265
4-chloro-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide
CID 63307748
5-(tert-butylsulfonylamino)-N-phenylpentanamide
CID 20631022
4-[4-(1,3-oxazol-5-yl)anilino]-4-oxobutanoic acid
CID 54866818
5-(tert-butylsulfonylamino)-N-[4-[(2-methylpropan-2-yl)oxy]phenyl]pentanamide
CID 20630752
2-(tert-butylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 78923690
3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 87046869
3-ethylsulfanyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 87046910
2,2-dimethyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 2806322
2-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 60812605

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide?
The IUPAC name of 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide (CID 20630720) is 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide.
What is the SMILES notation for 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide?
The canonical SMILES for 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide is CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(-c2cnco2)cc1.
What is the InChIKey of 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide?
The InChIKey is FDZDJCXYKJXUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O4S/c1-18(2,3)26(23,24)20-11-5-4-6-17(22)21-15-9-7-14(8-10-15)16-12-19-13-25-16/h7-10,12-13,20H,4-6,11H2,1-3H3,(H,21,22).
What are the key properties of 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide?
5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide has a molecular weight of 379.48 g/mol, XLogP of 3.17, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide is sourced from PubChem (CID 20630720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).