N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide

C20H18FN5O — CID 50948132

IUPACN-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide
SMILESO=C(CCc1cn2ccccc2n1)NCc1cn[nH]c1-c1ccc(F)cc1
InChIInChI=1S/C20H18FN5O/c21-16-6-4-14(5-7-16)20-15(12-23-25-20)11-22-19(27)9-8-17-13-26-10-2-1-3-18(26)24-17/h1-7,10,12-13H,8-9,11H2,(H,22,27)(H,23,25)
InChIKeyQVTNFUZTOHOTTD-UHFFFAOYSA-N
MW363.40 g/mol
LogP3.11
Rot. Bonds6

About N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide

N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide (PubChem CID 50948132) has the molecular formula C20H18FN5O and a molecular weight of 363.40 g/mol. Its IUPAC name is N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide.

Molecular Properties

Compound NameN-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide
PubChem CID50948132
Molecular FormulaC20H18FN5O
Molecular Weight363.40 g/mol
Exact Mass363.15
IUPAC NameN-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide
SMILESO=C(CCc1cn2ccccc2n1)NCc1cn[nH]c1-c1ccc(F)cc1
InChIInChI=1S/C20H18FN5O/c21-16-6-4-14(5-7-16)20-15(12-23-25-20)11-22-19(27)9-8-17-13-26-10-2-1-3-18(26)24-17/h1-7,10,12-13H,8-9,11H2,(H,22,27)(H,23,25)
InChIKeyQVTNFUZTOHOTTD-UHFFFAOYSA-N
XLogP3.11
TPSA75.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.40
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide?
The IUPAC name of N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide (CID 50948132) is N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide.
What is the SMILES notation for N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide?
The canonical SMILES for N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide is O=C(CCc1cn2ccccc2n1)NCc1cn[nH]c1-c1ccc(F)cc1.
What is the InChIKey of N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide?
The InChIKey is QVTNFUZTOHOTTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN5O/c21-16-6-4-14(5-7-16)20-15(12-23-25-20)11-22-19(27)9-8-17-13-26-10-2-1-3-18(26)24-17/h1-7,10,12-13H,8-9,11H2,(H,22,27)(H,23,25).
What are the key properties of N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide?
N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide has a molecular weight of 363.40 g/mol, XLogP of 3.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide is sourced from PubChem (CID 50948132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).