N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide

C18H18N4O2 — CID 46093845

IUPACN,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide
SMILESCc1noc(-c2ccncc2)c1C(=O)N(C)CCc1ccccn1
InChIInChI=1S/C18H18N4O2/c1-13-16(17(24-21-13)14-6-10-19-11-7-14)18(23)22(2)12-8-15-5-3-4-9-20-15/h3-7,9-11H,8,12H2,1-2H3
InChIKeyHHJRLYSEXLKNST-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.75
Rot. Bonds5

About N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide

N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide (PubChem CID 46093845) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide
PubChem CID46093845
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC NameN,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide
SMILESCc1noc(-c2ccncc2)c1C(=O)N(C)CCc1ccccn1
InChIInChI=1S/C18H18N4O2/c1-13-16(17(24-21-13)14-6-10-19-11-7-14)18(23)22(2)12-8-15-5-3-4-9-20-15/h3-7,9-11H,8,12H2,1-2H3
InChIKeyHHJRLYSEXLKNST-UHFFFAOYSA-N
XLogP2.75
TPSA72.12 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide 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

3-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 115646430
3-chloro-N-methyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 66463234
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158
N-methyl-5-(4-methylphenyl)-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 122137867
N-methyl-4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]-N-(2-pyridin-2-ylethyl)benzamide
CID 134008705
2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoacetic acid
CID 43445021
4-ethoxy-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 56809954
(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[methyl(2-pyridin-2-ylethyl)amino]acetic acid
CID 97194513
2-bromo-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 116816951
2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 115180171
N-methyl-3-[(2R)-2-phenylpropyl]-N-(2-pyridin-2-ylethyl)-1,2-oxazole-5-carboxamide
CID 42472241
N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide
CID 78796251

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide?
The IUPAC name of N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide (CID 46093845) is N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide?
The canonical SMILES for N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide is Cc1noc(-c2ccncc2)c1C(=O)N(C)CCc1ccccn1.
What is the InChIKey of N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide?
The InChIKey is HHJRLYSEXLKNST-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-13-16(17(24-21-13)14-6-10-19-11-7-14)18(23)22(2)12-8-15-5-3-4-9-20-15/h3-7,9-11H,8,12H2,1-2H3.
What are the key properties of N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide?
N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide has a molecular weight of 322.37 g/mol, XLogP of 2.75, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-5-pyridin-4-yl-N-(2-pyridin-2-ylethyl)-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 46093845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).