1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide

C23H26N4O2 — CID 172659026

IUPAC1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide
SMILESCCC(NC(=O)c1c(C)ccn(-c2cccc3c2CCC3)c1=O)c1ccnn1C
InChIInChI=1S/C23H26N4O2/c1-4-18(20-11-13-24-26(20)3)25-22(28)21-15(2)12-14-27(23(21)29)19-10-6-8-16-7-5-9-17(16)19/h6,8,10-14,18H,4-5,7,9H2,1-3H3,(H,25,28)
InChIKeyJLHQSMBFLRSNOZ-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.25
Rot. Bonds5

About 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide

1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide (PubChem CID 172659026) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide
PubChem CID172659026
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide
SMILESCCC(NC(=O)c1c(C)ccn(-c2cccc3c2CCC3)c1=O)c1ccnn1C
InChIInChI=1S/C23H26N4O2/c1-4-18(20-11-13-24-26(20)3)25-22(28)21-15(2)12-14-27(23(21)29)19-10-6-8-16-7-5-9-17(16)19/h6,8,10-14,18H,4-5,7,9H2,1-3H3,(H,25,28)
InChIKeyJLHQSMBFLRSNOZ-UHFFFAOYSA-N
XLogP3.25
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[2-(4-methyltriazol-1-yl)ethyl]-2-oxopyridine-3-carboxamide
CID 172664831
1-(2,3-dihydro-1H-inden-4-yl)-N-[3-(3,5-dimethyl-1,2,4-triazol-1-yl)propyl]-4-methyl-2-oxopyridine-3-carboxamide
CID 172657422
1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide
CID 172658005
1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-oxopyridine-3-carboxamide
CID 172672760
1-(2,3-dihydro-1H-inden-5-yl)-3-[(1S)-1-(2-methylpyrazol-3-yl)propyl]urea
CID 124845668
1-(2,3-dihydro-1H-inden-4-yl)-3-[4-(1H-imidazol-2-yl)piperidine-1-carbonyl]-4-methylpyridin-2-one
CID 172664608
3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one
CID 172659336
3-[(3aS,6aS)-3a-(hydroxymethyl)-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one
CID 172672864
N-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-2-(1,2,4-triazol-4-yl)benzamide
CID 126425657
3-hydroxy-N-[1-(2-methylpyrazol-3-yl)propyl]pyridine-2-carboxamide
CID 91773008
1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carbonyl]pyridin-2-one
CID 172665955
2-(methylamino)-N-[1-(2-methylpyrazol-3-yl)propyl]pyridine-4-carboxamide
CID 50968548

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide (CID 172659026) is 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide is CCC(NC(=O)c1c(C)ccn(-c2cccc3c2CCC3)c1=O)c1ccnn1C.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide?
The InChIKey is JLHQSMBFLRSNOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-4-18(20-11-13-24-26(20)3)25-22(28)21-15(2)12-14-27(23(21)29)19-10-6-8-16-7-5-9-17(16)19/h6,8,10-14,18H,4-5,7,9H2,1-3H3,(H,25,28).
What are the key properties of 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide?
1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-[1-(2-methylpyrazol-3-yl)propyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172659026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).