6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide

C20H18FN5O2 — CID 122510610

IUPAC6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCC(CO)n1cnc(-c2ccc(F)cc2)c1-c1ccc2ncc(C(N)=O)n2c1
InChIInChI=1S/C20H18FN5O2/c1-12(10-27)26-11-24-18(13-2-5-15(21)6-3-13)19(26)14-4-7-17-23-8-16(20(22)28)25(17)9-14/h2-9,11-12,27H,10H2,1H3,(H2,22,28)
InChIKeyINHDCVCKHWQYEP-UHFFFAOYSA-N
MW379.40 g/mol
LogP2.66
Rot. Bonds5

About 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide

6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 122510610) has the molecular formula C20H18FN5O2 and a molecular weight of 379.40 g/mol. Its IUPAC name is 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID122510610
Molecular FormulaC20H18FN5O2
Molecular Weight379.40 g/mol
Exact Mass379.14
IUPAC Name6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCC(CO)n1cnc(-c2ccc(F)cc2)c1-c1ccc2ncc(C(N)=O)n2c1
InChIInChI=1S/C20H18FN5O2/c1-12(10-27)26-11-24-18(13-2-5-15(21)6-3-13)19(26)14-4-7-17-23-8-16(20(22)28)25(17)9-14/h2-9,11-12,27H,10H2,1H3,(H2,22,28)
InChIKeyINHDCVCKHWQYEP-UHFFFAOYSA-N
XLogP2.66
TPSA98.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.40
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide (CID 122510610) is 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide is CC(CO)n1cnc(-c2ccc(F)cc2)c1-c1ccc2ncc(C(N)=O)n2c1.
What is the InChIKey of 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is INHDCVCKHWQYEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN5O2/c1-12(10-27)26-11-24-18(13-2-5-15(21)6-3-13)19(26)14-4-7-17-23-8-16(20(22)28)25(17)9-14/h2-9,11-12,27H,10H2,1H3,(H2,22,28).
What are the key properties of 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 379.40 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(4-fluorophenyl)-3-(1-hydroxypropan-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 122510610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).