N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide

C22H22N2O2 — CID 86939454

IUPACN-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
SMILESCCN(CC1CC1)C(=O)c1ccccc1-c1ncc(-c2ccccc2)o1
InChIInChI=1S/C22H22N2O2/c1-2-24(15-16-12-13-16)22(25)19-11-7-6-10-18(19)21-23-14-20(26-21)17-8-4-3-5-9-17/h3-11,14,16H,2,12-13,15H2,1H3
InChIKeyHJJZGILCOCNWBV-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.88
Rot. Bonds6

About N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide

N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide (PubChem CID 86939454) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
PubChem CID86939454
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC NameN-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
SMILESCCN(CC1CC1)C(=O)c1ccccc1-c1ncc(-c2ccccc2)o1
InChIInChI=1S/C22H22N2O2/c1-2-24(15-16-12-13-16)22(25)19-11-7-6-10-18(19)21-23-14-20(26-21)17-8-4-3-5-9-17/h3-11,14,16H,2,12-13,15H2,1H3
InChIKeyHJJZGILCOCNWBV-UHFFFAOYSA-N
XLogP4.88
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N,N-diethylbenzamide
CID 100509744
2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N,N-diethylbenzamide
CID 100513460
N-ethyl-2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(oxolan-2-ylmethyl)benzamide
CID 47790086
N-benzyl-N-(2-hydroxyethyl)-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 78855254
2-(5-phenyl-1,3-oxazol-2-yl)-N-propylbenzamide
CID 24654497
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 60618248
(3-ethylpiperidin-1-yl)-[2-(5-phenyl-1,3-oxazol-2-yl)phenyl]methanone
CID 55654983
2-[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]benzoic acid
CID 100503714
1-[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]piperidine-4-carboxylic acid
CID 119166332
butyl 2-(5-phenyl-1,3-oxazol-2-yl)benzoate
CID 22764943
N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 133150056
2-[cyclobutylmethyl(ethyl)carbamoyl]benzoic acid
CID 107397528

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The IUPAC name of N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide (CID 86939454) is N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide is CCN(CC1CC1)C(=O)c1ccccc1-c1ncc(-c2ccccc2)o1.
What is the InChIKey of N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The InChIKey is HJJZGILCOCNWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-2-24(15-16-12-13-16)22(25)19-11-7-6-10-18(19)21-23-14-20(26-21)17-8-4-3-5-9-17/h3-11,14,16H,2,12-13,15H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide has a molecular weight of 346.43 g/mol, XLogP of 4.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-ethyl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide is sourced from PubChem (CID 86939454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).