N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide

C19H23FN4O2 — CID 71836358

IUPACN-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide
SMILESCCC(=O)NCc1nc2c(n1CC)CN(C(=O)c1ccccc1F)CC2
InChIInChI=1S/C19H23FN4O2/c1-3-18(25)21-11-17-22-15-9-10-23(12-16(15)24(17)4-2)19(26)13-7-5-6-8-14(13)20/h5-8H,3-4,9-12H2,1-2H3,(H,21,25)
InChIKeyFOIIUYHZHWLHRO-UHFFFAOYSA-N
MW358.42 g/mol
LogP2.27
Rot. Bonds5

About N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide

N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide (PubChem CID 71836358) has the molecular formula C19H23FN4O2 and a molecular weight of 358.42 g/mol. Its IUPAC name is N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide.

Molecular Properties

Compound NameN-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide
PubChem CID71836358
Molecular FormulaC19H23FN4O2
Molecular Weight358.42 g/mol
Exact Mass358.18
IUPAC NameN-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide
SMILESCCC(=O)NCc1nc2c(n1CC)CN(C(=O)c1ccccc1F)CC2
InChIInChI=1S/C19H23FN4O2/c1-3-18(25)21-11-17-22-15-9-10-23(12-16(15)24(17)4-2)19(26)13-7-5-6-8-14(13)20/h5-8H,3-4,9-12H2,1-2H3,(H,21,25)
InChIKeyFOIIUYHZHWLHRO-UHFFFAOYSA-N
XLogP2.27
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide with MolForge

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Related Compounds

N-[[3-ethyl-5-[2-(4-fluorophenyl)acetyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide
CID 83273778
N-[[3-methyl-5-(2-methylbenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide
CID 71836360
N-[[5-(2-methoxybenzoyl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide
CID 71836363
(2-fluorophenyl)-(1,4,8-triazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraen-4-yl)methanone
CID 110872524
N-[[3-ethyl-5-(4-methoxybenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]cyclobutanecarboxamide
CID 53191063
methyl 5-(2-fluorobenzoyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxylate
CID 66609439
3,4-dihydro-1H-isoquinolin-2-yl-(2-fluorophenyl)methanone
CID 669198
N-[[5-(2,4-difluorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide
CID 71835755
(2-fluorophenyl)-[3-(propan-2-yldiazenyl)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl]methanone
CID 54103637
2-fluoro-N-[2-[4-(2-fluorobenzoyl)piperazin-1-yl]ethyl]benzamide
CID 3455522
2-fluoro-N-[(1R)-1-[1-(2-fluorobenzoyl)piperidin-4-yl]-2-(2-methoxyethylamino)-2-oxoethyl]benzamide
CID 93196379
1-(2-fluorobenzoyl)-4-(2-methylpropyl)-1,4-diazepan-5-one
CID 26345937

Frequently Asked Questions

What is the IUPAC name of N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide?
The IUPAC name of N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide (CID 71836358) is N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide.
What is the SMILES notation for N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide?
The canonical SMILES for N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide is CCC(=O)NCc1nc2c(n1CC)CN(C(=O)c1ccccc1F)CC2.
What is the InChIKey of N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide?
The InChIKey is FOIIUYHZHWLHRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN4O2/c1-3-18(25)21-11-17-22-15-9-10-23(12-16(15)24(17)4-2)19(26)13-7-5-6-8-14(13)20/h5-8H,3-4,9-12H2,1-2H3,(H,21,25).
What are the key properties of N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide?
N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide has a molecular weight of 358.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-ethyl-5-(2-fluorobenzoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]methyl]propanamide is sourced from PubChem (CID 71836358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).