N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide

C10H11N3O2 — CID 143984517

IUPACN-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide
SMILESCNc1ccc2nc(NC(C)=O)oc2c1
InChIInChI=1S/C10H11N3O2/c1-6(14)12-10-13-8-4-3-7(11-2)5-9(8)15-10/h3-5,11H,1-2H3,(H,12,13,14)
InChIKeyPTUUKPFFPGEBFQ-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.83
Rot. Bonds2

About N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide

N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide (PubChem CID 143984517) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide
PubChem CID143984517
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC NameN-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide
SMILESCNc1ccc2nc(NC(C)=O)oc2c1
InChIInChI=1S/C10H11N3O2/c1-6(14)12-10-13-8-4-3-7(11-2)5-9(8)15-10/h3-5,11H,1-2H3,(H,12,13,14)
InChIKeyPTUUKPFFPGEBFQ-UHFFFAOYSA-N
XLogP1.83
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-acetamido-1,3-benzoxazol-6-yl)acetamide
CID 952763
N-(6-acetamido-1,3-benzoxazol-2-yl)thiophene-2-carboxamide
CID 953622
6-(methylamino)-1,3-benzoxazole-2-carbonitrile
CID 46908315
N-(6-acetamido-1,3-benzoxazol-2-yl)-2-(4-tert-butylphenoxy)acetamide
CID 40603845
N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-2-chlorobenzamide
CID 3904553
N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-3,5-dimethoxybenzamide
CID 3897977
N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]naphthalene-1-carboxamide
CID 3983187
N-(6-acetamido-1,3-benzoxazol-2-yl)-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 39380610
N-(6-acetamido-1,3-benzoxazol-2-yl)-2-[4-[(2S)-butan-2-yl]phenoxy]acetamide
CID 40607430
N-(2-methyl-1,3-benzoxazol-6-yl)carbamoyl bromide
CID 115193310
N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-3-bromo-4-methoxybenzamide
CID 3581247
3-[6-(methylamino)-1,3-benzoxazol-2-yl]-4-oxo-4-sulfanylbutanoic acid
CID 57264662

Frequently Asked Questions

What is the IUPAC name of N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide?
The IUPAC name of N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide (CID 143984517) is N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide.
What is the SMILES notation for N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide?
The canonical SMILES for N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide is CNc1ccc2nc(NC(C)=O)oc2c1.
What is the InChIKey of N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide?
The InChIKey is PTUUKPFFPGEBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-6(14)12-10-13-8-4-3-7(11-2)5-9(8)15-10/h3-5,11H,1-2H3,(H,12,13,14).
What are the key properties of N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide?
N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide has a molecular weight of 205.22 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(methylamino)-1,3-benzoxazol-2-yl]acetamide is sourced from PubChem (CID 143984517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).