4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide

C13H23N3O2 — CID 120564064

IUPAC4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide
SMILESCCc1noc(CC)c1CNC(=O)CCC(C)N
InChIInChI=1S/C13H23N3O2/c1-4-11-10(12(5-2)18-16-11)8-15-13(17)7-6-9(3)14/h9H,4-8,14H2,1-3H3,(H,15,17)
InChIKeyNPFWPBJMEAQCLV-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.54
Rot. Bonds7

About 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide

4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide (PubChem CID 120564064) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide
PubChem CID120564064
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide
SMILESCCc1noc(CC)c1CNC(=O)CCC(C)N
InChIInChI=1S/C13H23N3O2/c1-4-11-10(12(5-2)18-16-11)8-15-13(17)7-6-9(3)14/h9H,4-8,14H2,1-3H3,(H,15,17)
InChIKeyNPFWPBJMEAQCLV-UHFFFAOYSA-N
XLogP1.54
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]propanamide;hydrochloride
CID 119344939
2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride
CID 119344945
3-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]-2-methylbutanamide;hydrochloride
CID 120502331
(2S)-2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]-3,3-dimethylbutanamide
CID 119821091
1-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]-3-ethylurea
CID 71972681
N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]but-2-ynamide
CID 146076189
1-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]cyclopentane-1-carboxamide
CID 119344958
9-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120992210
(2S)-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]-2-(difluoromethyl)pyrrolidine-1-carboxamide
CID 138010131
(4R)-4-amino-N-propylpentanamide
CID 146234117
(3S)-3-[(3,5-diethyl-1,2-oxazol-4-yl)methylamino]-N-(2,3-dimethylphenyl)butanamide
CID 97323529
4-amino-5-chloro-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]-2-methoxybenzamide
CID 119821115

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide?
The IUPAC name of 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide (CID 120564064) is 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide.
What is the SMILES notation for 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide?
The canonical SMILES for 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide is CCc1noc(CC)c1CNC(=O)CCC(C)N.
What is the InChIKey of 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide?
The InChIKey is NPFWPBJMEAQCLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-4-11-10(12(5-2)18-16-11)8-15-13(17)7-6-9(3)14/h9H,4-8,14H2,1-3H3,(H,15,17).
What are the key properties of 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide?
4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide has a molecular weight of 253.35 g/mol, XLogP of 1.54, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]pentanamide is sourced from PubChem (CID 120564064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).