4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide

C14H17N3O3 — CID 103154918

IUPAC4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide
SMILESCOC(CN)CC(=O)Nc1ccc(-c2cnco2)cc1
InChIInChI=1S/C14H17N3O3/c1-19-12(7-15)6-14(18)17-11-4-2-10(3-5-11)13-8-16-9-20-13/h2-5,8-9,12H,6-7,15H2,1H3,(H,17,18)
InChIKeyBQFVGSDWHBSLRY-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.64
Rot. Bonds6

About 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide

4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide (PubChem CID 103154918) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide.

Molecular Properties

Compound Name4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide
PubChem CID103154918
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide
SMILESCOC(CN)CC(=O)Nc1ccc(-c2cnco2)cc1
InChIInChI=1S/C14H17N3O3/c1-19-12(7-15)6-14(18)17-11-4-2-10(3-5-11)13-8-16-9-20-13/h2-5,8-9,12H,6-7,15H2,1H3,(H,17,18)
InChIKeyBQFVGSDWHBSLRY-UHFFFAOYSA-N
XLogP1.64
TPSA90.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 60812605
4-amino-N-(4-hydroxyphenyl)-3-methoxybutanamide
CID 103154769
6-amino-N-[4-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 60927435
4-[4-(1,3-oxazol-5-yl)anilino]-4-oxobutanoic acid
CID 54866818
2-(tert-butylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 78923690
ethyl N-[4-[(4-amino-3-methoxybutanoyl)amino]phenyl]carbamate
CID 103154656
2-amino-3-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide;hydrochloride
CID 119724910
4-amino-N-[4-(difluoromethoxy)phenyl]-3-methoxybutanamide;hydrochloride
CID 120586597
4-chloro-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide
CID 63307748
2-(2-methylphenyl)-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 87008248
2-(1-aminocyclopentyl)-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 64684075
3-ethylsulfanyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 87046910

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide?
The IUPAC name of 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide (CID 103154918) is 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide.
What is the SMILES notation for 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide?
The canonical SMILES for 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide is COC(CN)CC(=O)Nc1ccc(-c2cnco2)cc1.
What is the InChIKey of 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide?
The InChIKey is BQFVGSDWHBSLRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-19-12(7-15)6-14(18)17-11-4-2-10(3-5-11)13-8-16-9-20-13/h2-5,8-9,12H,6-7,15H2,1H3,(H,17,18).
What are the key properties of 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide?
4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide has a molecular weight of 275.31 g/mol, XLogP of 1.64, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide is sourced from PubChem (CID 103154918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).