N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide

C20H19N5O2 — CID 139782439

IUPACN-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide
SMILESCc1cnc2c(NC(=O)c3ccncc3)cccc2c1N1CCN(C)C1=O
InChIInChI=1S/C20H19N5O2/c1-13-12-22-17-15(18(13)25-11-10-24(2)20(25)27)4-3-5-16(17)23-19(26)14-6-8-21-9-7-14/h3-9,12H,10-11H2,1-2H3,(H,23,26)
InChIKeyZEINSIFUAVOVSQ-UHFFFAOYSA-N
MW361.41 g/mol
LogP3.06
Rot. Bonds3

About N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide

N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide (PubChem CID 139782439) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide
PubChem CID139782439
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC NameN-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide
SMILESCc1cnc2c(NC(=O)c3ccncc3)cccc2c1N1CCN(C)C1=O
InChIInChI=1S/C20H19N5O2/c1-13-12-22-17-15(18(13)25-11-10-24(2)20(25)27)4-3-5-16(17)23-19(26)14-6-8-21-9-7-14/h3-9,12H,10-11H2,1-2H3,(H,23,26)
InChIKeyZEINSIFUAVOVSQ-UHFFFAOYSA-N
XLogP3.06
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 53.06
H-Bond Donors ≤ 51
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]pyridine-4-carboxamide?
The IUPAC name of N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide (CID 139782439) is N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide?
The canonical SMILES for N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide is Cc1cnc2c(NC(=O)c3ccncc3)cccc2c1N1CCN(C)C1=O.
What is the InChIKey of N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide?
The InChIKey is ZEINSIFUAVOVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-13-12-22-17-15(18(13)25-11-10-24(2)20(25)27)4-3-5-16(17)23-19(26)14-6-8-21-9-7-14/h3-9,12H,10-11H2,1-2H3,(H,23,26).
What are the key properties of N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide?
N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]pyridine-4-carboxamide has a molecular weight of 361.41 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 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]pyridine-4-carboxamide is sourced from PubChem (CID 139782439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).