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

C23H23N3O3 — CID 172658005

IUPAC1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2c(C)ccn(-c3cccc4c3CCC4)c2=O)ccn1
InChIInChI=1S/C23H23N3O3/c1-15-10-12-26(19-8-4-6-17-5-3-7-18(17)19)23(28)21(15)22(27)25-14-16-9-11-24-20(13-16)29-2/h4,6,8-13H,3,5,7,14H2,1-2H3,(H,25,27)
InChIKeyAYFMDPYFXZZKTE-UHFFFAOYSA-N
MW389.46 g/mol
LogP2.97
Rot. Bonds5

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

1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide (PubChem CID 172658005) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide
PubChem CID172658005
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2c(C)ccn(-c3cccc4c3CCC4)c2=O)ccn1
InChIInChI=1S/C23H23N3O3/c1-15-10-12-26(19-8-4-6-17-5-3-7-18(17)19)23(28)21(15)22(27)25-14-16-9-11-24-20(13-16)29-2/h4,6,8-13H,3,5,7,14H2,1-2H3,(H,25,27)
InChIKeyAYFMDPYFXZZKTE-UHFFFAOYSA-N
XLogP2.97
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 52.97
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
2-amino-N-[(2-methoxy-4-pyridinyl)methyl]-6-methylbenzamide
CID 62990733
N-(3,4-dihydro-2H-chromen-6-ylmethyl)-1-(6-methoxy-3-pyridinyl)-4-methyl-2-oxopyridine-3-carboxamide
CID 172664352
N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydroindole-1-carboxamide
CID 47032081
2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 81394679
3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 43046318
N-[(2-methoxy-4-pyridinyl)methyl]-4,5-dimethyl-2-pyrrol-1-ylthiophene-3-carboxamide
CID 51112604
N-[(2-methoxy-4-pyridinyl)methyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 142859474
1-(2,3-dihydro-1H-inden-4-yl)-4-methyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-oxopyridine-3-carboxamide
CID 172672760
N-[(2-methoxy-4-pyridinyl)methyl]pyridine-4-carboxamide
CID 47142420
3-amino-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62072661
N-[(2-methoxy-4-pyridinyl)methyl]-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazole-3-carboxamide
CID 55775483

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide (CID 172658005) is 1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide is COc1cc(CNC(=O)c2c(C)ccn(-c3cccc4c3CCC4)c2=O)ccn1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide?
The InChIKey is AYFMDPYFXZZKTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-15-10-12-26(19-8-4-6-17-5-3-7-18(17)19)23(28)21(15)22(27)25-14-16-9-11-24-20(13-16)29-2/h4,6,8-13H,3,5,7,14H2,1-2H3,(H,25,27).
What are the key properties of 1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide?
1-(2,3-dihydro-1H-inden-4-yl)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 2.97, 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)-N-[(2-methoxy-4-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172658005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).