2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide

C18H23N3O3 — CID 48632188

IUPAC2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide
SMILESCOc1ccc(-c2cnc(CN(CC(N)=O)C3CCCC3)o2)cc1
InChIInChI=1S/C18H23N3O3/c1-23-15-8-6-13(7-9-15)16-10-20-18(24-16)12-21(11-17(19)22)14-4-2-3-5-14/h6-10,14H,2-5,11-12H2,1H3,(H2,19,22)
InChIKeyOEXFFXXMMLFMOM-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.58
Rot. Bonds7

About 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide

2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide (PubChem CID 48632188) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide.

Molecular Properties

Compound Name2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide
PubChem CID48632188
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC Name2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide
SMILESCOc1ccc(-c2cnc(CN(CC(N)=O)C3CCCC3)o2)cc1
InChIInChI=1S/C18H23N3O3/c1-23-15-8-6-13(7-9-15)16-10-20-18(24-16)12-21(11-17(19)22)14-4-2-3-5-14/h6-10,14H,2-5,11-12H2,1H3,(H2,19,22)
InChIKeyOEXFFXXMMLFMOM-UHFFFAOYSA-N
XLogP2.58
TPSA81.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide?
The IUPAC name of 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide (CID 48632188) is 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide.
What is the SMILES notation for 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide?
The canonical SMILES for 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide is COc1ccc(-c2cnc(CN(CC(N)=O)C3CCCC3)o2)cc1.
What is the InChIKey of 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide?
The InChIKey is OEXFFXXMMLFMOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-23-15-8-6-13(7-9-15)16-10-20-18(24-16)12-21(11-17(19)22)14-4-2-3-5-14/h6-10,14H,2-5,11-12H2,1H3,(H2,19,22).
What are the key properties of 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide?
2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide has a molecular weight of 329.40 g/mol, XLogP of 2.58, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]methyl]amino]acetamide is sourced from PubChem (CID 48632188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).