6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane

C23H29N3O — CID 142369043

IUPAC6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane
SMILESCC.CCn1cc(C)c(=O)c2cc(N(C)C3Cc4ccccc4C3)cnc21
InChIInChI=1S/C21H23N3O.C2H6/c1-4-24-13-14(2)20(25)19-11-18(12-22-21(19)24)23(3)17-9-15-7-5-6-8-16(15)10-17;1-2/h5-8,11-13,17H,4,9-10H2,1-3H3;1-2H3
InChIKeyIIVHAZWOVPPBKC-UHFFFAOYSA-N
MW363.51 g/mol
LogP4.35
Rot. Bonds3

About 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane

6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane (PubChem CID 142369043) has the molecular formula C23H29N3O and a molecular weight of 363.51 g/mol. Its IUPAC name is 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane.

Molecular Properties

Compound Name6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane
PubChem CID142369043
Molecular FormulaC23H29N3O
Molecular Weight363.51 g/mol
Exact Mass363.23
IUPAC Name6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane
SMILESCC.CCn1cc(C)c(=O)c2cc(N(C)C3Cc4ccccc4C3)cnc21
InChIInChI=1S/C21H23N3O.C2H6/c1-4-24-13-14(2)20(25)19-11-18(12-22-21(19)24)23(3)17-9-15-7-5-6-8-16(15)10-17;1-2/h5-8,11-13,17H,4,9-10H2,1-3H3;1-2H3
InChIKeyIIVHAZWOVPPBKC-UHFFFAOYSA-N
XLogP4.35
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.51
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane with MolForge

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Related Compounds

6-[4-[(3S,4R)-4-(dimethylamino)-1-(7-fluoro-2,3-dihydro-1H-inden-1-yl)pyrrolidin-3-yl]piperidin-1-yl]pyridine-3-carboxamide
CID 132085570
BNC-210
CID 24772165
2-Phenyl-1,8-naphthyridin-4-ol
CID 377427
5-Fluoro-2-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-2,3-dihydroinden-1-one
CID 164622487
1-(2,3-dihydro-1H-inden-5-yl)-4-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one
CID 164628817
3-[(4-Pyridin-2-ylpiperazin-1-yl)methyl]-2,3-dihydroinden-1-one
CID 11141324
2-[(E)-3-[6-(cyclopentylamino)-3-pyridinyl]-3-oxoprop-1-enyl]benzonitrile
CID 44251419
11-[3-(Dimethylamino)propyl]-11,13,18-triazatetracyclo[8.8.0.02,7.012,17]octadeca-1(18),2,4,6,9,12(17),13,15-octaen-8-one
CID 118731445
11-(3-Piperidin-1-ylpropyl)-11,13,18-triazatetracyclo[8.8.0.02,7.012,17]octadeca-1(18),2,4,6,9,12(17),13,15-octaen-8-one
CID 118731446
2-[[4-(4-Pyridin-2-ylpiperazin-1-yl)phenyl]methylidene]indene-1,3-dione
CID 127050946
6-Methyl-2-p-tolyl-1H-[1,8]naphthyridin-4-one
CID 10682119
N-[2-(5-fluoro-2-methylphenyl)-4-oxo-1H-1,7-naphthyridin-6-yl]cyclopropanecarboxamide
CID 67974895

Frequently Asked Questions

What is the IUPAC name of 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane?
The IUPAC name of 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane (CID 142369043) is 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane.
What is the SMILES notation for 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane?
The canonical SMILES for 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane is CC.CCn1cc(C)c(=O)c2cc(N(C)C3Cc4ccccc4C3)cnc21.
What is the InChIKey of 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane?
The InChIKey is IIVHAZWOVPPBKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O.C2H6/c1-4-24-13-14(2)20(25)19-11-18(12-22-21(19)24)23(3)17-9-15-7-5-6-8-16(15)10-17;1-2/h5-8,11-13,17H,4,9-10H2,1-3H3;1-2H3.
What are the key properties of 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane?
6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane has a molecular weight of 363.51 g/mol, XLogP of 4.35, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-1-ethyl-3-methyl-1,8-naphthyridin-4-one;ethane is sourced from PubChem (CID 142369043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).