2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide

C17H15N5O2 — CID 155948899

IUPAC2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide
SMILESCn1c(CNC(=O)Cc2noc3ccccc23)nc2cccnc21
InChIInChI=1S/C17H15N5O2/c1-22-15(20-12-6-4-8-18-17(12)22)10-19-16(23)9-13-11-5-2-3-7-14(11)24-21-13/h2-8H,9-10H2,1H3,(H,19,23)
InChIKeyMGMXMODJFJKUSD-UHFFFAOYSA-N
MW321.34 g/mol
LogP1.97
Rot. Bonds4

About 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide

2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide (PubChem CID 155948899) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide
PubChem CID155948899
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC Name2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide
SMILESCn1c(CNC(=O)Cc2noc3ccccc23)nc2cccnc21
InChIInChI=1S/C17H15N5O2/c1-22-15(20-12-6-4-8-18-17(12)22)10-19-16(23)9-13-11-5-2-3-7-14(11)24-21-13/h2-8H,9-10H2,1H3,(H,19,23)
InChIKeyMGMXMODJFJKUSD-UHFFFAOYSA-N
XLogP1.97
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide with MolForge

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Related Compounds

2-(1,2-benzoxazol-3-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 46612175
2-(1,2-benzoxazol-3-yl)-N-(2,3-dihydroxy-2-methylpropyl)acetamide
CID 66170629
2-(1,2-benzoxazol-3-yl)-N-(2-chloro-3-pyridinyl)acetamide
CID 1235388
2-(1,2-benzoxazol-3-yl)-N-(3-methyl-2-pyridinyl)acetamide
CID 22519739
2-(1,2-benzoxazol-3-yl)-N-propan-2-ylacetamide
CID 15167155
2-(1,2-benzoxazol-3-yl)-N-[(6-methylpyrimidin-4-yl)methyl]acetamide
CID 122263355
2-(1,2-benzoxazol-3-yl)-N-[[4-(2-methoxyethoxy)phenyl]methyl]acetamide
CID 46461744
2-(1,2-benzoxazol-3-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
CID 22519759
2-(1,2-benzoxazol-3-yl)-N-(4,5,6-trimethylpyrimidin-2-yl)acetamide
CID 162626547
2-(1,2-benzoxazol-3-yl)-N-(3-hydroxy-4-methylpentyl)acetamide
CID 111461213
2-(1,2-benzoxazol-3-yl)-N-[(2,4-dimethylphenyl)methyl]acetamide
CID 52572922
2-(1,2-benzoxazol-3-yl)-N-(2-cyanopropan-2-yl)acetamide
CID 61127889

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide?
The IUPAC name of 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide (CID 155948899) is 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide?
The canonical SMILES for 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide is Cn1c(CNC(=O)Cc2noc3ccccc23)nc2cccnc21.
What is the InChIKey of 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide?
The InChIKey is MGMXMODJFJKUSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-22-15(20-12-6-4-8-18-17(12)22)10-19-16(23)9-13-11-5-2-3-7-14(11)24-21-13/h2-8H,9-10H2,1H3,(H,19,23).
What are the key properties of 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide?
2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide has a molecular weight of 321.34 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-benzoxazol-3-yl)-N-[(3-methylimidazo[4,5-b]pyridin-2-yl)methyl]acetamide is sourced from PubChem (CID 155948899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).