N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide

C23H23N5O2 — CID 139782388

IUPACN-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide
SMILESCc1cnc2c(NC(=O)c3cccc4c3CCN4)cccc2c1N1CCN(C)C1=O
InChIInChI=1S/C23H23N5O2/c1-14-13-25-20-17(21(14)28-12-11-27(2)23(28)30)6-4-8-19(20)26-22(29)16-5-3-7-18-15(16)9-10-24-18/h3-8,13,24H,9-12H2,1-2H3,(H,26,29)
InChIKeyKLIMQQMORCQQGY-UHFFFAOYSA-N
MW401.47 g/mol
LogP3.64
Rot. Bonds3

About N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide

N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide (PubChem CID 139782388) has the molecular formula C23H23N5O2 and a molecular weight of 401.47 g/mol. Its IUPAC name is N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide
PubChem CID139782388
Molecular FormulaC23H23N5O2
Molecular Weight401.47 g/mol
Exact Mass401.19
IUPAC NameN-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide
SMILESCc1cnc2c(NC(=O)c3cccc4c3CCN4)cccc2c1N1CCN(C)C1=O
InChIInChI=1S/C23H23N5O2/c1-14-13-25-20-17(21(14)28-12-11-27(2)23(28)30)6-4-8-19(20)26-22(29)16-5-3-7-18-15(16)9-10-24-18/h3-8,13,24H,9-12H2,1-2H3,(H,26,29)
InChIKeyKLIMQQMORCQQGY-UHFFFAOYSA-N
XLogP3.64
TPSA77.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide?
The IUPAC name of N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide (CID 139782388) is N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide.
What is the SMILES notation for N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide?
The canonical SMILES for N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide is Cc1cnc2c(NC(=O)c3cccc4c3CCN4)cccc2c1N1CCN(C)C1=O.
What is the InChIKey of N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide?
The InChIKey is KLIMQQMORCQQGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2/c1-14-13-25-20-17(21(14)28-12-11-27(2)23(28)30)6-4-8-19(20)26-22(29)16-5-3-7-18-15(16)9-10-24-18/h3-8,13,24H,9-12H2,1-2H3,(H,26,29).
What are the key properties of N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide?
N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide has a molecular weight of 401.47 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-2,3-dihydro-1H-indole-4-carboxamide is sourced from PubChem (CID 139782388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).