(3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone

C24H20FN5O — CID 163345283

IUPAC(3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccncc1F)N1CCC(c2ccc3cc(-c4ccncc4)cnc3n2)CC1
InChIInChI=1S/C24H20FN5O/c25-21-15-27-10-5-20(21)24(31)30-11-6-17(7-12-30)22-2-1-18-13-19(14-28-23(18)29-22)16-3-8-26-9-4-16/h1-5,8-10,13-15,17H,6-7,11-12H2
InChIKeyINUIZQBSOHODMN-UHFFFAOYSA-N
MW413.46 g/mol
LogP4.25
Rot. Bonds3

About (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone

(3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone (PubChem CID 163345283) has the molecular formula C24H20FN5O and a molecular weight of 413.46 g/mol. Its IUPAC name is (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
PubChem CID163345283
Molecular FormulaC24H20FN5O
Molecular Weight413.46 g/mol
Exact Mass413.17
IUPAC Name(3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccncc1F)N1CCC(c2ccc3cc(-c4ccncc4)cnc3n2)CC1
InChIInChI=1S/C24H20FN5O/c25-21-15-27-10-5-20(21)24(31)30-11-6-17(7-12-30)22-2-1-18-13-19(14-28-23(18)29-22)16-3-8-26-9-4-16/h1-5,8-10,13-15,17H,6-7,11-12H2
InChIKeyINUIZQBSOHODMN-UHFFFAOYSA-N
XLogP4.25
TPSA71.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.46
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone with MolForge

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Launch Full Analysis

Related Compounds

(2-methylpyrazol-3-yl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155975284
(3-methylimidazol-4-yl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155975312
(1-methyltriazol-4-yl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155975295
1-(4-methylpiperidin-1-yl)-2-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]ethanone
CID 163346995
(5-methyl-1,2-oxazol-4-yl)-[4-(6-pyrimidin-5-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155980899
(3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone
CID 64950699
[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyrimidin-4-ylmethanone
CID 163344506
[4-(6-cyclopropyl-1,8-naphthyridin-2-yl)piperidin-1-yl]-(5-fluoro-3-pyridinyl)methanone
CID 163348592
[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 163344454
3-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]pyrazine-2-carbonitrile
CID 155977261
2-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]-6-pyridin-4-yl-1,8-naphthyridine
CID 155975409
(3-fluoro-4-pyridinyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 115646457

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone?
The IUPAC name of (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone (CID 163345283) is (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone is O=C(c1ccncc1F)N1CCC(c2ccc3cc(-c4ccncc4)cnc3n2)CC1.
What is the InChIKey of (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone?
The InChIKey is INUIZQBSOHODMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN5O/c25-21-15-27-10-5-20(21)24(31)30-11-6-17(7-12-30)22-2-1-18-13-19(14-28-23(18)29-22)16-3-8-26-9-4-16/h1-5,8-10,13-15,17H,6-7,11-12H2.
What are the key properties of (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone?
(3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone has a molecular weight of 413.46 g/mol, XLogP of 4.25, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 163345283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).