1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one

C22H24N4O3 — CID 90566061

IUPAC1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one
SMILESCCn1cc(C(=O)N2CCC(Oc3cccnc3)CC2)c(=O)c2ccc(C)nc21
InChIInChI=1S/C22H24N4O3/c1-3-25-14-19(20(27)18-7-6-15(2)24-21(18)25)22(28)26-11-8-16(9-12-26)29-17-5-4-10-23-13-17/h4-7,10,13-14,16H,3,8-9,11-12H2,1-2H3
InChIKeyKMQPXZBTNLFSCV-UHFFFAOYSA-N
MW392.46 g/mol
LogP2.80
Rot. Bonds4

About 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one

1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one (PubChem CID 90566061) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one
PubChem CID90566061
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC Name1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one
SMILESCCn1cc(C(=O)N2CCC(Oc3cccnc3)CC2)c(=O)c2ccc(C)nc21
InChIInChI=1S/C22H24N4O3/c1-3-25-14-19(20(27)18-7-6-15(2)24-21(18)25)22(28)26-11-8-16(9-12-26)29-17-5-4-10-23-13-17/h4-7,10,13-14,16H,3,8-9,11-12H2,1-2H3
InChIKeyKMQPXZBTNLFSCV-UHFFFAOYSA-N
XLogP2.80
TPSA77.32 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one with MolForge

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Related Compounds

1-ethyl-7-methyl-3-[(3R)-3-pyrazin-2-yloxypiperidine-1-carbonyl]-1,8-naphthyridin-4-one
CID 100645703
1-ethyl-7-methyl-3-[(3S)-3-pyrazin-2-yloxypiperidine-1-carbonyl]-1,8-naphthyridin-4-one
CID 100645686
1-ethyl-3-[4-[(2-ethylimidazol-1-yl)methyl]piperidine-1-carbonyl]-7-methyl-1,8-naphthyridin-4-one
CID 90493323
3-[4-[(3,5-dimethylpyrazol-1-yl)methyl]piperidine-1-carbonyl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one
CID 90495193
3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-ethyl-7-methyl-1,8-naphthyridin-4-one
CID 43811695
1-ethyl-7-methyl-3-[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]azetidine-1-carbonyl]-1,8-naphthyridin-4-one
CID 122247626
6-[1-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile
CID 122248820
1-ethyl-7-methyl-3-[4-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-2-yl)piperidine-1-carbonyl]-1,8-naphthyridin-4-one
CID 46952858
1-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 42650197
3-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazole-2-carbonyl)-1-ethyl-7-methyl-1,8-naphthyridin-4-one
CID 5309135
3-(7,7-dimethyl-6,8-dioxa-2-azaspiro[3.5]nonane-2-carbonyl)-1-ethyl-7-methyl-1,8-naphthyridin-4-one
CID 90537434
3-[4-[1-(1,1-dioxothiolan-3-yl)-3,5-dimethylpyrazol-4-yl]piperazine-1-carbonyl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one
CID 90506951

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one?
The IUPAC name of 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one (CID 90566061) is 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one.
What is the SMILES notation for 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one?
The canonical SMILES for 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one is CCn1cc(C(=O)N2CCC(Oc3cccnc3)CC2)c(=O)c2ccc(C)nc21.
What is the InChIKey of 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one?
The InChIKey is KMQPXZBTNLFSCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-3-25-14-19(20(27)18-7-6-15(2)24-21(18)25)22(28)26-11-8-16(9-12-26)29-17-5-4-10-23-13-17/h4-7,10,13-14,16H,3,8-9,11-12H2,1-2H3.
What are the key properties of 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one?
1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one has a molecular weight of 392.46 g/mol, XLogP of 2.80, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-7-methyl-3-(4-pyridin-3-yloxypiperidine-1-carbonyl)-1,8-naphthyridin-4-one is sourced from PubChem (CID 90566061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).