N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide

C17H16FN3O2 — CID 70719847

IUPACN-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(c1ccc2nccn2c1)N(CCO)Cc1ccccc1F
InChIInChI=1S/C17H16FN3O2/c18-15-4-2-1-3-13(15)11-21(9-10-22)17(23)14-5-6-16-19-7-8-20(16)12-14/h1-8,12,22H,9-11H2
InChIKeyKBXPWZDDXVLSEX-UHFFFAOYSA-N
MW313.33 g/mol
LogP2.11
Rot. Bonds5

About N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide

N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 70719847) has the molecular formula C17H16FN3O2 and a molecular weight of 313.33 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID70719847
Molecular FormulaC17H16FN3O2
Molecular Weight313.33 g/mol
Exact Mass313.12
IUPAC NameN-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(c1ccc2nccn2c1)N(CCO)Cc1ccccc1F
InChIInChI=1S/C17H16FN3O2/c18-15-4-2-1-3-13(15)11-21(9-10-22)17(23)14-5-6-16-19-7-8-20(16)12-14/h1-8,12,22H,9-11H2
InChIKeyKBXPWZDDXVLSEX-UHFFFAOYSA-N
XLogP2.11
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.33
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorophenyl)-N-imidazo[1,2-a]pyridin-6-ylacetamide
CID 110734742
N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)-2-methyl-4-phenylpyridine-3-carboxamide
CID 77087747
N-[(2-methylphenyl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 110703963
N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide
CID 70706926
N-(2-hydroxyethyl)-N-(2-phenylethyl)imidazo[1,2-a]pyridine-7-carboxamide
CID 75390476
N-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 70727068
N-[2-(4-chlorophenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 110703993
N-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 50948386
methyl 3-[(2,3-difluorophenyl)methyl-(tetrazolo[1,5-a]pyridine-6-carbonyl)amino]propanoate
CID 146089709
N-[2-(3-chlorophenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 110704025
N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
CID 60654052
N-[(2-fluorophenyl)methyl]-N',N'-bis(2-hydroxyethyl)oxamide
CID 108509953

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 70719847) is N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide is O=C(c1ccc2nccn2c1)N(CCO)Cc1ccccc1F.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is KBXPWZDDXVLSEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O2/c18-15-4-2-1-3-13(15)11-21(9-10-22)17(23)14-5-6-16-19-7-8-20(16)12-14/h1-8,12,22H,9-11H2.
What are the key properties of N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide?
N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 313.33 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 70719847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).