(4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone

C19H18F2N4O2 — CID 168987929

IUPAC(4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone
SMILESCOc1ccc2nn(-c3ccc(C(=O)N4CCC(F)(F)CC4)cn3)cc2c1
InChIInChI=1S/C19H18F2N4O2/c1-27-15-3-4-16-14(10-15)12-25(23-16)17-5-2-13(11-22-17)18(26)24-8-6-19(20,21)7-9-24/h2-5,10-12H,6-9H2,1H3
InChIKeyHFSDLJKCDFHBPY-UHFFFAOYSA-N
MW372.38 g/mol
LogP3.30
Rot. Bonds3

About (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone

(4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone (PubChem CID 168987929) has the molecular formula C19H18F2N4O2 and a molecular weight of 372.38 g/mol. Its IUPAC name is (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone.

Molecular Properties

Compound Name(4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone
PubChem CID168987929
Molecular FormulaC19H18F2N4O2
Molecular Weight372.38 g/mol
Exact Mass372.14
IUPAC Name(4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone
SMILESCOc1ccc2nn(-c3ccc(C(=O)N4CCC(F)(F)CC4)cn3)cc2c1
InChIInChI=1S/C19H18F2N4O2/c1-27-15-3-4-16-14(10-15)12-25(23-16)17-5-2-13(11-22-17)18(26)24-8-6-19(20,21)7-9-24/h2-5,10-12H,6-9H2,1H3
InChIKeyHFSDLJKCDFHBPY-UHFFFAOYSA-N
XLogP3.30
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.38
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(4,4-difluoropiperidin-1-yl)-(6-pyrazol-1-yl-3-pyridinyl)methanone
CID 110090789
[6-(difluoromethyl)-3-pyridinyl]-[4-(5-methoxy-2-pyridinyl)piperazin-1-yl]methanone
CID 136551075
[6-(5-bromoindazol-1-yl)-3-pyridinyl]-(4,4-difluoropiperidin-1-yl)methanone
CID 168987901
(4,4-difluoropiperidin-1-yl)-[6-(3-ethylphenyl)-3-pyridinyl]methanone
CID 123839744
6-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]pyridine-3-carboxylic acid
CID 83971609
(4,4-difluoropiperidin-1-yl)-(5-fluoro-6-methyl-3-pyridinyl)methanone
CID 168987947
[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-[4-(4-methoxyphenyl)-1,4-diazepan-1-yl]methanone
CID 55917792
(4,4-difluoropiperidin-1-yl)-(2,6-dimethyl-4-pyridinyl)methanone
CID 77094058
(7-methoxyquinolin-3-yl)-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)methanone
CID 171681019
[4-(4-methoxybenzoyl)piperazin-1-yl]-phenylmethanone
CID 3150576
(4,4-difluoropiperidin-1-yl)-[6-(5-morpholin-4-ylindazol-1-yl)-3-pyridinyl]methanone
CID 168987891
[3-fluoro-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-(6-methoxy-3-pyridinyl)methanone
CID 166604531

Frequently Asked Questions

What is the IUPAC name of (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone?
The IUPAC name of (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone (CID 168987929) is (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone.
What is the SMILES notation for (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone?
The canonical SMILES for (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone is COc1ccc2nn(-c3ccc(C(=O)N4CCC(F)(F)CC4)cn3)cc2c1.
What is the InChIKey of (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone?
The InChIKey is HFSDLJKCDFHBPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F2N4O2/c1-27-15-3-4-16-14(10-15)12-25(23-16)17-5-2-13(11-22-17)18(26)24-8-6-19(20,21)7-9-24/h2-5,10-12H,6-9H2,1H3.
What are the key properties of (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone?
(4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone has a molecular weight of 372.38 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4,4-difluoropiperidin-1-yl)-[6-(5-methoxyindazol-2-yl)-3-pyridinyl]methanone is sourced from PubChem (CID 168987929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).