N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide

C15H12N2O3 — CID 110388202

IUPACN-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc3ocnc3c2)c1
InChIInChI=1S/C15H12N2O3/c1-19-12-4-2-3-11(8-12)17-15(18)10-5-6-14-13(7-10)16-9-20-14/h2-9H,1H3,(H,17,18)
InChIKeyBGPSCGXVKHJGAN-UHFFFAOYSA-N
MW268.27 g/mol
LogP3.09
Rot. Bonds3

About N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide

N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide (PubChem CID 110388202) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide
PubChem CID110388202
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC NameN-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc3ocnc3c2)c1
InChIInChI=1S/C15H12N2O3/c1-19-12-4-2-3-11(8-12)17-15(18)10-5-6-14-13(7-10)16-9-20-14/h2-9H,1H3,(H,17,18)
InChIKeyBGPSCGXVKHJGAN-UHFFFAOYSA-N
XLogP3.09
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-methoxyphenyl)-1,3-benzoxazole-5-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

N-(3-methoxyphenyl)-1,3-benzoxazole-6-carboxamide
CID 110765121
N-(3-methoxyphenyl)-2-methyl-1,3-benzoxazole-5-carboxamide
CID 110388014
N-(4-anilinophenyl)-1,3-benzoxazole-5-carboxamide
CID 108795166
4-acetyl-N-(3-methoxyphenyl)benzamide
CID 16640996
N-(3-methoxyphenyl)-2-propan-2-yl-1,3-benzoxazole-6-carboxamide
CID 53089494
2-N,5-N-bis(3-methoxyphenyl)pyridine-2,5-dicarboxamide
CID 1368781
1-N-[4-(dimethylamino)phenyl]-4-N-(3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109050069
N-(4-phenylmethoxyphenyl)-1,3-benzoxazole-5-carboxamide
CID 110388232
N-[3-(6-oxo-1H-pyridazin-3-yl)phenyl]-1,3-benzoxazole-5-carboxamide
CID 108811725
4-(aminomethyl)-N-(3-methoxyphenyl)benzamide
CID 16796099
N-(3-methoxyphenyl)-4-propan-2-ylbenzamide
CID 897049
N-[(3-iodophenyl)carbamoyl]-1,3-benzoxazole-5-carboxamide
CID 10179540

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide (CID 110388202) is N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide is COc1cccc(NC(=O)c2ccc3ocnc3c2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide?
The InChIKey is BGPSCGXVKHJGAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c1-19-12-4-2-3-11(8-12)17-15(18)10-5-6-14-13(7-10)16-9-20-14/h2-9H,1H3,(H,17,18).
What are the key properties of N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide?
N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide has a molecular weight of 268.27 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-1,3-benzoxazole-5-carboxamide is sourced from PubChem (CID 110388202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).