6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide

C19H20FN3O2 — CID 91949305

IUPAC6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
SMILESCC(=O)N1Cc2cccnc2C(C(=O)NCCc2ccc(F)cc2)C1
InChIInChI=1S/C19H20FN3O2/c1-13(24)23-11-15-3-2-9-21-18(15)17(12-23)19(25)22-10-8-14-4-6-16(20)7-5-14/h2-7,9,17H,8,10-12H2,1H3,(H,22,25)
InChIKeyIGGSMYCQNLHCKI-UHFFFAOYSA-N
MW341.39 g/mol
LogP2.03
Rot. Bonds4

About 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide

6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide (PubChem CID 91949305) has the molecular formula C19H20FN3O2 and a molecular weight of 341.39 g/mol. Its IUPAC name is 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide.

Molecular Properties

Compound Name6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
PubChem CID91949305
Molecular FormulaC19H20FN3O2
Molecular Weight341.39 g/mol
Exact Mass341.15
IUPAC Name6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
SMILESCC(=O)N1Cc2cccnc2C(C(=O)NCCc2ccc(F)cc2)C1
InChIInChI=1S/C19H20FN3O2/c1-13(24)23-11-15-3-2-9-21-18(15)17(12-23)19(25)22-10-8-14-4-6-16(20)7-5-14/h2-7,9,17H,8,10-12H2,1H3,(H,22,25)
InChIKeyIGGSMYCQNLHCKI-UHFFFAOYSA-N
XLogP2.03
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(7S)-N-[2-(4-fluorophenyl)ethyl]-2-methyl-5-(3-phenylpropanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide
CID 129360922
5-(cyclopentanecarbonyl)-N-[2-(4-fluorophenyl)ethyl]-2-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide
CID 110248188
6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949112
6-acetyl-N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949207
6-acetyl-N-(1-pyridin-2-ylethyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949302
6-(furan-2-carbonyl)-N-(2-methoxyethyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949384
6-acetyl-N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949189
6-acetyl-N-(5-methyl-2-propylpyrazol-3-yl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949133
1-[8-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanone
CID 91949310
N-[2-(4-fluorophenyl)ethyl]-2-methyl-5-[(4-propan-2-ylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide
CID 110248193
(7S)-N-[2-(4-fluorophenyl)ethyl]-2-methyl-5-[(4-propan-2-ylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-7-carboxamide
CID 92621168
(3R,4R)-1-[4-[(3R,4R)-3,4-bis[2-(4-fluorophenyl)ethylcarbamoyl]pyrrolidine-1-carbonyl]benzoyl]-3-N,4-N-bis(2-phenylethyl)pyrrolidine-3,4-dicarboxamide
CID 145434363

Frequently Asked Questions

What is the IUPAC name of 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The IUPAC name of 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide (CID 91949305) is 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide.
What is the SMILES notation for 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The canonical SMILES for 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide is CC(=O)N1Cc2cccnc2C(C(=O)NCCc2ccc(F)cc2)C1.
What is the InChIKey of 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The InChIKey is IGGSMYCQNLHCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O2/c1-13(24)23-11-15-3-2-9-21-18(15)17(12-23)19(25)22-10-8-14-4-6-16(20)7-5-14/h2-7,9,17H,8,10-12H2,1H3,(H,22,25).
What are the key properties of 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide has a molecular weight of 341.39 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetyl-N-[2-(4-fluorophenyl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide is sourced from PubChem (CID 91949305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).