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

C18H23N3O3 — CID 56813192

IUPAC2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide
SMILESCOc1ccc(-c2nc(CN(CC(N)=O)C3CCCC3)co2)cc1
InChIInChI=1S/C18H23N3O3/c1-23-16-8-6-13(7-9-16)18-20-14(12-24-18)10-21(11-17(19)22)15-4-2-3-5-15/h6-9,12,15H,2-5,10-11H2,1H3,(H2,19,22)
InChIKeyGTMIJTCOTKRQGK-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.58
Rot. Bonds7

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

2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide (PubChem CID 56813192) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide.

Molecular Properties

Compound Name2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide
PubChem CID56813192
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC Name2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide
SMILESCOc1ccc(-c2nc(CN(CC(N)=O)C3CCCC3)co2)cc1
InChIInChI=1S/C18H23N3O3/c1-23-16-8-6-13(7-9-16)18-20-14(12-24-18)10-21(11-17(19)22)15-4-2-3-5-15/h6-9,12,15H,2-5,10-11H2,1H3,(H2,19,22)
InChIKeyGTMIJTCOTKRQGK-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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Related Compounds

N-cyclopropyl-2-[[2-(4-ethoxyphenyl)-5-methyl-4-oxazolyl]methylthio]acetamide
CID 4174238
2-(4-Ethoxyphenyl)-5-morpholin-4-yl-1,3-oxazole-4-carbonitrile
CID 891985
2-(4-Ethoxyphenyl)-5-(prop-2-enylamino)-1,3-oxazole-4-carbonitrile
CID 1984543
2-(4-Methoxyphenyl)-5-(prop-2-enylamino)-1,3-oxazole-4-carbonitrile
CID 2941177
2-[[2-(4-ethoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-N-(2-furanylmethyl)acetamide
CID 3237327
N-(2-furylmethyl)-2-({[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}thio)acetamide
CID 3240944
2-({[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}thio)-N-(2-morpholin-4-ylethyl)acetamide
CID 3245551
2-{4-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenoxy]-phenyl}-oxazole
CID 9884772
2-[cyclohexyl-[2-[2-(3,4-dimethoxyphenyl)-1,3-oxazol-4-yl]acetyl]amino]-N-cyclopentylpropanamide
CID 53393839
2-Amino-2-[2-[4-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]phenyl]ethyl]propane-1,3-diol;hydrochloride
CID 118716158
(E)-3-fluoro-2-[[4-(4-methyl-1,3-oxazol-2-yl)phenoxy]methyl]prop-2-en-1-amine
CID 146512022
(Z)-3-fluoro-2-[[4-(4-methyl-1,3-oxazol-2-yl)phenoxy]methyl]prop-2-en-1-amine
CID 162369031

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide?
The IUPAC name of 2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide (CID 56813192) is 2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide.
What is the SMILES notation for 2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide?
The canonical SMILES for 2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide is COc1ccc(-c2nc(CN(CC(N)=O)C3CCCC3)co2)cc1.
What is the InChIKey of 2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide?
The InChIKey is GTMIJTCOTKRQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-23-16-8-6-13(7-9-16)18-20-14(12-24-18)10-21(11-17(19)22)15-4-2-3-5-15/h6-9,12,15H,2-5,10-11H2,1H3,(H2,19,22).
What are the key properties of 2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide?
2-[cyclopentyl-[[2-(4-methoxyphenyl)-1,3-oxazol-4-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-[[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl]amino]acetamide is sourced from PubChem (CID 56813192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).