2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide

C20H24N2O4 — CID 163308884

IUPAC2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide
SMILESO=C(COc1ccccc1-c1ocnc1CC1CC1)NCC1CCCO1
InChIInChI=1S/C20H24N2O4/c23-19(21-11-15-4-3-9-24-15)12-25-18-6-2-1-5-16(18)20-17(22-13-26-20)10-14-7-8-14/h1-2,5-6,13-15H,3-4,7-12H2,(H,21,23)
InChIKeyDHYJZPDSWQYPKV-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.97
Rot. Bonds8

About 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide

2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide (PubChem CID 163308884) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide
PubChem CID163308884
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide
SMILESO=C(COc1ccccc1-c1ocnc1CC1CC1)NCC1CCCO1
InChIInChI=1S/C20H24N2O4/c23-19(21-11-15-4-3-9-24-15)12-25-18-6-2-1-5-16(18)20-17(22-13-26-20)10-14-7-8-14/h1-2,5-6,13-15H,3-4,7-12H2,(H,21,23)
InChIKeyDHYJZPDSWQYPKV-UHFFFAOYSA-N
XLogP2.97
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(oxolan-2-ylmethyl)-2-(2-phenylphenoxy)acetamide
CID 18168438
2-[2-[2-oxo-2-(oxolan-2-ylmethylamino)ethoxy]phenyl]acetic acid
CID 80721764
2-[2-(1H-benzimidazol-2-yl)phenoxy]-N-(oxolan-2-ylmethyl)acetamide
CID 168554617
2-[2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide
CID 50746083
2-(2-nitrophenoxy)-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 717198
4-[[[2-[2-oxo-2-(oxolan-2-ylmethylamino)ethoxy]phenyl]methylamino]methyl]benzoic acid
CID 122030533
2-methyl-3-[2-oxo-2-(oxolan-2-ylmethylamino)ethoxy]benzoic acid
CID 82810102
2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 874788
[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl] 2-(2-cyanophenoxy)acetate
CID 2372728
N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 18168439
4-methyl-3-[2-oxo-2-(oxolan-2-ylmethylamino)ethoxy]benzoic acid
CID 60698794
[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 2-(2-phenoxyethoxy)benzoate
CID 8921899

Frequently Asked Questions

What is the IUPAC name of 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide?
The IUPAC name of 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide (CID 163308884) is 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide is O=C(COc1ccccc1-c1ocnc1CC1CC1)NCC1CCCO1.
What is the InChIKey of 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide?
The InChIKey is DHYJZPDSWQYPKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c23-19(21-11-15-4-3-9-24-15)12-25-18-6-2-1-5-16(18)20-17(22-13-26-20)10-14-7-8-14/h1-2,5-6,13-15H,3-4,7-12H2,(H,21,23).
What are the key properties of 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide?
2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide has a molecular weight of 356.42 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide is sourced from PubChem (CID 163308884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).