N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide

C24H24F2N4O2 — CID 44528363

IUPACN-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc3c(c2)CCN3C2CCN(Cc3cccc(F)c3F)C2)no1
InChIInChI=1S/C24H24F2N4O2/c1-15-11-21(28-32-15)24(31)27-18-5-6-22-16(12-18)7-10-30(22)19-8-9-29(14-19)13-17-3-2-4-20(25)23(17)26/h2-6,11-12,19H,7-10,13-14H2,1H3,(H,27,31)
InChIKeyCVYXKRZNBJASOM-UHFFFAOYSA-N
MW438.48 g/mol
LogP4.15
Rot. Bonds5

About N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide

N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 44528363) has the molecular formula C24H24F2N4O2 and a molecular weight of 438.48 g/mol. Its IUPAC name is N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID44528363
Molecular FormulaC24H24F2N4O2
Molecular Weight438.48 g/mol
Exact Mass438.19
IUPAC NameN-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc3c(c2)CCN3C2CCN(Cc3cccc(F)c3F)C2)no1
InChIInChI=1S/C24H24F2N4O2/c1-15-11-21(28-32-15)24(31)27-18-5-6-22-16(12-18)7-10-30(22)19-8-9-29(14-19)13-17-3-2-4-20(25)23(17)26/h2-6,11-12,19H,7-10,13-14H2,1H3,(H,27,31)
InChIKeyCVYXKRZNBJASOM-UHFFFAOYSA-N
XLogP4.15
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.48
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-[1-[1-[(4-prop-1-en-2-ylcyclohexen-1-yl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-1,2-oxazole-3-carboxamide
CID 44528373
5-methyl-N-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1,2-oxazole-3-carboxamide
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5-methyl-N-[3-[(5-methyl-1,2-oxazole-3-carbonyl)amino]phenyl]-1,2-oxazole-3-carboxamide
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1-[(2,3-difluorophenyl)methyl]-3-methylpiperidin-4-ol
CID 114502450
N-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 2812630
N-[1-[1-[2-(2,4-difluorophenyl)ethyl]piperidin-4-yl]-2,3-dihydroindol-6-yl]acetamide
CID 22038010
N-[3-[(cyclopropylamino)methyl]phenyl]-5-methyl-1,2-oxazole-3-carboxamide
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CID 118790819
2-(5-methyl-1,2-oxazol-3-yl)-N-[1-(2-methylpropanoyl)-2,3-dihydroindol-5-yl]acetamide
CID 110609553
N-(2,3-dihydro-1H-indol-5-yl)-5-methyl-1,2-oxazole-3-carboxamide
CID 55168760
N-(1,3-benzodioxol-5-yl)-5-methyl-1,2-oxazole-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide (CID 44528363) is N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)Nc2ccc3c(c2)CCN3C2CCN(Cc3cccc(F)c3F)C2)no1.
What is the InChIKey of N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is CVYXKRZNBJASOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24F2N4O2/c1-15-11-21(28-32-15)24(31)27-18-5-6-22-16(12-18)7-10-30(22)19-8-9-29(14-19)13-17-3-2-4-20(25)23(17)26/h2-6,11-12,19H,7-10,13-14H2,1H3,(H,27,31).
What are the key properties of N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide?
N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 438.48 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[1-[(2,3-difluorophenyl)methyl]pyrrolidin-3-yl]-2,3-dihydroindol-5-yl]-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 44528363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).