1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide

C22H23FN4O2 — CID 142580302

IUPAC1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide
SMILESO=C(C1CC1)N1CCCc2nc(C3(C(=O)Nc4ccc(F)cn4)CCC3)ccc21
InChIInChI=1S/C22H23FN4O2/c23-15-6-9-19(24-13-15)26-21(29)22(10-2-11-22)18-8-7-17-16(25-18)3-1-12-27(17)20(28)14-4-5-14/h6-9,13-14H,1-5,10-12H2,(H,24,26,29)
InChIKeyGTZKWZGPAAWYQH-UHFFFAOYSA-N
MW394.45 g/mol
LogP3.37
Rot. Bonds4

About 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide

1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide (PubChem CID 142580302) has the molecular formula C22H23FN4O2 and a molecular weight of 394.45 g/mol. Its IUPAC name is 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide
PubChem CID142580302
Molecular FormulaC22H23FN4O2
Molecular Weight394.45 g/mol
Exact Mass394.18
IUPAC Name1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide
SMILESO=C(C1CC1)N1CCCc2nc(C3(C(=O)Nc4ccc(F)cn4)CCC3)ccc21
InChIInChI=1S/C22H23FN4O2/c23-15-6-9-19(24-13-15)26-21(29)22(10-2-11-22)18-8-7-17-16(25-18)3-1-12-27(17)20(28)14-4-5-14/h6-9,13-14H,1-5,10-12H2,(H,24,26,29)
InChIKeyGTZKWZGPAAWYQH-UHFFFAOYSA-N
XLogP3.37
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.45
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide with MolForge

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Related Compounds

cyclopropyl 6-[1-[(4-fluorophenyl)carbamoyl]cyclobutyl]-3,4-dihydro-2H-1,5-naphthyridine-1-carboxylate
CID 142580380
4-fluoro-N-methylaniline;1-[5-(oxane-4-carbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]cyclobutane-1-carbaldehyde
CID 142580386
2-(4-fluorophenyl)-1-[1-[5-(oxane-2-carbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]cyclobutyl]ethanone
CID 159405619
N-[1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]ethyl]-4-fluorobenzamide
CID 142580536
tert-butyl 6-[3-[(4-fluorophenyl)carbamoyl]oxetan-3-yl]-3,4-dihydro-2H-1,5-naphthyridine-1-carboxylate
CID 155093209
N-(5-fluoro-2-pyridinyl)-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)cyclobutane-1-carboxamide
CID 142580499
N-(5-fluoro-2-pyridinyl)-1-[1-(6-methylpyrimidine-4-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]cyclobutane-1-carboxamide
CID 142580336
cyclopropyl 6-[1-[2-(4-chlorophenyl)acetyl]cyclobutyl]-3,4-dihydro-2H-1,5-naphthyridine-1-carboxylate
CID 159733918
1-[(5-fluoro-2-pyridinyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 65481473
N-(4-fluorophenyl)-5-[5-(2-methylpyrimidin-4-yl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]spiro[2.3]hexane-5-carboxamide
CID 142580291
N-(4-chlorophenyl)-1-[5-[6-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-6H-1,5-naphthyridin-2-yl]cyclobutane-1-carboxamide
CID 155093046
N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]-3-(4-fluorophenyl)propanamide
CID 110623188

Frequently Asked Questions

What is the IUPAC name of 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide?
The IUPAC name of 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide (CID 142580302) is 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide.
What is the SMILES notation for 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide?
The canonical SMILES for 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide is O=C(C1CC1)N1CCCc2nc(C3(C(=O)Nc4ccc(F)cn4)CCC3)ccc21.
What is the InChIKey of 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide?
The InChIKey is GTZKWZGPAAWYQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN4O2/c23-15-6-9-19(24-13-15)26-21(29)22(10-2-11-22)18-8-7-17-16(25-18)3-1-12-27(17)20(28)14-4-5-14/h6-9,13-14H,1-5,10-12H2,(H,24,26,29).
What are the key properties of 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide?
1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide has a molecular weight of 394.45 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(cyclopropanecarbonyl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]-N-(5-fluoro-2-pyridinyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 142580302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).