5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide

C20H22N4O3 — CID 135323976

IUPAC5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2cccc3c2CCN3)c1=O
InChIInChI=1S/C20H22N4O3/c1-21-19(26)16-9-13(18(25)23-14-5-6-14)11-24(20(16)27)10-12-3-2-4-17-15(12)7-8-22-17/h2-4,9,11,14,22H,5-8,10H2,1H3,(H,21,26)(H,23,25)
InChIKeyQQNSTELFURUZJX-UHFFFAOYSA-N
MW366.42 g/mol
LogP1.12
Rot. Bonds5

About 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide

5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide (PubChem CID 135323976) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
PubChem CID135323976
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2cccc3c2CCN3)c1=O
InChIInChI=1S/C20H22N4O3/c1-21-19(26)16-9-13(18(25)23-14-5-6-14)11-24(20(16)27)10-12-3-2-4-17-15(12)7-8-22-17/h2-4,9,11,14,22H,5-8,10H2,1H3,(H,21,26)(H,23,25)
InChIKeyQQNSTELFURUZJX-UHFFFAOYSA-N
XLogP1.12
TPSA92.23 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-allyl-N-(3,4-dimethylphenyl)-2-oxo-1,2-dihydro-3-pyridinecarboxamide
CID 1486113
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N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1-propan-2-ylquinoline-3-carboxamide
CID 44248793
5-N-cyclobutyl-3-N-methyl-1-[[3-(methylamino)phenyl]methyl]-2-oxopyridine-3,5-dicarboxamide
CID 126676126
1H-Isoindole-1,3(2H)-dione, 2-methyl-4-(methylamino)-
CID 75996
4-Ethylamino-2-methyl-isoindole-1,3-dione
CID 654584
N-(7-Methyl-2-oxo-1,2-dihydro-quinolin-3-ylmethyl)-N-(2-o-tolyl-ethyl)-acetamide
CID 1453407
N-(2-methyl-1,3-dioxoisoindolin-4-yl)cyclohexanecarboxamide
CID 3604482
3-(3,4-dimethylphenyl)-5-(indoline-1-carbonyl)pyrimidine-2,4(1H,3H)-dione
CID 3627251
N-[2-(cyclohexen-1-yl)ethyl]-1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 24981557
N-[(1S,5R)-8-ethyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1-propan-2-ylquinoline-3-carboxamide
CID 44249055
N-[(1S,5R)-8-octyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1-propan-2-ylquinoline-3-carboxamide
CID 44249056

Frequently Asked Questions

What is the IUPAC name of 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide (CID 135323976) is 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide is CNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2cccc3c2CCN3)c1=O.
What is the InChIKey of 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The InChIKey is QQNSTELFURUZJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-21-19(26)16-9-13(18(25)23-14-5-6-14)11-24(20(16)27)10-12-3-2-4-17-15(12)7-8-22-17/h2-4,9,11,14,22H,5-8,10H2,1H3,(H,21,26)(H,23,25).
What are the key properties of 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide has a molecular weight of 366.42 g/mol, XLogP of 1.12, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclopropyl-1-(2,3-dihydro-1H-indol-4-ylmethyl)-3-N-methyl-2-oxopyridine-3,5-dicarboxamide is sourced from PubChem (CID 135323976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).