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

C11H19N3O3 — CID 81088105

IUPAC2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide
SMILESCOCCCC(N)C(=O)NCc1cc(C)no1
InChIInChI=1S/C11H19N3O3/c1-8-6-9(17-14-8)7-13-11(15)10(12)4-3-5-16-2/h6,10H,3-5,7,12H2,1-2H3,(H,13,15)
InChIKeyPFVNMJYUGMRYMF-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.35
Rot. Bonds7

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

2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide (PubChem CID 81088105) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide
PubChem CID81088105
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide
SMILESCOCCCC(N)C(=O)NCc1cc(C)no1
InChIInChI=1S/C11H19N3O3/c1-8-6-9(17-14-8)7-13-11(15)10(12)4-3-5-16-2/h6,10H,3-5,7,12H2,1-2H3,(H,13,15)
InChIKeyPFVNMJYUGMRYMF-UHFFFAOYSA-N
XLogP0.35
TPSA90.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.35
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

methyl N-[(3-methyl-1,2-oxazol-5-yl)methyl]carbamate
CID 115598489
2-amino-N-benzyl-5-methoxypentanamide
CID 81081027
2-amino-N-[(2-hydroxyphenyl)methyl]-5-methoxypentanamide
CID 114332295
(2S)-2-amino-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-phenylacetamide
CID 104897754
2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide
CID 114186098
2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide
CID 81081158
ethyl N-[(3-methyl-1,2-oxazol-5-yl)methyl]carbamate
CID 62189875
3-chloro-2-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propanamide
CID 62726666
2-hydroxyethyl N-[(3-methyl-1,2-oxazol-5-yl)methyl]carbamate
CID 79348723
2-amino-N-[(3-bromophenyl)methyl]-5-methoxypentanamide
CID 81089386
2-amino-5-methoxy-N-propylpentanamide
CID 81082005
2-amino-N-[[4-(dimethylamino)phenyl]methyl]-5-methoxypentanamide
CID 81088409

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide?
The IUPAC name of 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide (CID 81088105) is 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide.
What is the SMILES notation for 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide?
The canonical SMILES for 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide is COCCCC(N)C(=O)NCc1cc(C)no1.
What is the InChIKey of 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide?
The InChIKey is PFVNMJYUGMRYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-8-6-9(17-14-8)7-13-11(15)10(12)4-3-5-16-2/h6,10H,3-5,7,12H2,1-2H3,(H,13,15).
What are the key properties of 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide?
2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide has a molecular weight of 241.29 g/mol, XLogP of 0.35, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide is sourced from PubChem (CID 81088105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).