(4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone

C16H15N3O2 — CID 169097375

IUPAC(4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone
SMILESCCOc1ccn2c(C(=O)c3ccc(N)cc3)cnc2c1
InChIInChI=1S/C16H15N3O2/c1-2-21-13-7-8-19-14(10-18-15(19)9-13)16(20)11-3-5-12(17)6-4-11/h3-10H,2,17H2,1H3
InChIKeyCMQMRPRBJUVOAO-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.55
Rot. Bonds4

About (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone

(4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone (PubChem CID 169097375) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone.

Molecular Properties

Compound Name(4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone
PubChem CID169097375
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name(4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone
SMILESCCOc1ccn2c(C(=O)c3ccc(N)cc3)cnc2c1
InChIInChI=1S/C16H15N3O2/c1-2-21-13-7-8-19-14(10-18-15(19)9-13)16(20)11-3-5-12(17)6-4-11/h3-10H,2,17H2,1H3
InChIKeyCMQMRPRBJUVOAO-UHFFFAOYSA-N
XLogP2.55
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(4-aminophenyl)-(6-methylimidazo[1,2-a]pyridin-3-yl)methanone
CID 170560043
1-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]ethanone
CID 165143384
(4-aminophenyl)-(2,5-diethoxyphenyl)methanone
CID 82267801
7-(2,2-difluoroethoxy)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 7-(2,2-difluoroethoxy)imidazo[1,2-a]pyridine-3-carboxylate
CID 161088998
ethyl 7-fluoroimidazo[1,2-a]pyridine-3-carboxylate
CID 67259301
7-[2-(4-methylpiperazin-1-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide
CID 67252366
ethyl 7-amino-3-(4-methoxybenzoyl)indolizine-1-carboxylate
CID 171462969
ethyl 7-[2-(3,4-dimethylpiperazin-1-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxylate
CID 123846928
1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[4-(7-methoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]urea
CID 170560018
(4-amino-3,5-dichlorophenyl)-(4-ethoxyphenyl)methanone
CID 116609755
4-(imidazo[1,2-a]pyridine-3-carbonyl)benzoic acid
CID 67003128
ethyl 7-[3-(4-fluoro-4-methylpiperidin-1-yl)propoxy]imidazo[1,2-a]pyridine-3-carboxylate
CID 178051681

Frequently Asked Questions

What is the IUPAC name of (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone?
The IUPAC name of (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone (CID 169097375) is (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone.
What is the SMILES notation for (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone?
The canonical SMILES for (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone is CCOc1ccn2c(C(=O)c3ccc(N)cc3)cnc2c1.
What is the InChIKey of (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone?
The InChIKey is CMQMRPRBJUVOAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-2-21-13-7-8-19-14(10-18-15(19)9-13)16(20)11-3-5-12(17)6-4-11/h3-10H,2,17H2,1H3.
What are the key properties of (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone?
(4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone has a molecular weight of 281.32 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminophenyl)-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)methanone is sourced from PubChem (CID 169097375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).