(4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone

C24H25N3O3 — CID 160731330

IUPAC(4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone
SMILESCC1(C(=O)N2CCN(C(=O)c3ccc(-c4ccc5occc5n4)cc3)CC2)CCC1
InChIInChI=1S/C24H25N3O3/c1-24(10-2-11-24)23(29)27-14-12-26(13-15-27)22(28)18-5-3-17(4-6-18)19-7-8-21-20(25-19)9-16-30-21/h3-9,16H,2,10-15H2,1H3
InChIKeyRUJMSOXOXVWROY-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.97
Rot. Bonds3

About (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone

(4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone (PubChem CID 160731330) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone
PubChem CID160731330
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC Name(4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone
SMILESCC1(C(=O)N2CCN(C(=O)c3ccc(-c4ccc5occc5n4)cc3)CC2)CCC1
InChIInChI=1S/C24H25N3O3/c1-24(10-2-11-24)23(29)27-14-12-26(13-15-27)22(28)18-5-3-17(4-6-18)19-7-8-21-20(25-19)9-16-30-21/h3-9,16H,2,10-15H2,1H3
InChIKeyRUJMSOXOXVWROY-UHFFFAOYSA-N
XLogP3.97
TPSA66.65 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone with MolForge

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Related Compounds

[4-(1-aminocyclobutanecarbonyl)piperazin-1-yl]-[4-(1H-pyrrolo[3,2-b]pyridin-5-yl)phenyl]methanone
CID 162300450
(4-furo[3,2-c]pyridin-4-ylphenyl)-[4-(1-hydroxycyclopropanecarbonyl)piperazin-1-yl]methanone
CID 118621474
[4-(1-methylcyclopropanecarbonyl)piperazin-1-yl]-[4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone
CID 161202899
azepan-1-yl-[4-[6-[(1R)-1-hydroxyethyl]-2-pyridinyl]phenyl]methanone
CID 125439003
[4-(1,3-dimethylindazol-6-yl)phenyl]-[4-(1-methylcyclopropanecarbonyl)piperazin-1-yl]methanone
CID 159397655
(2,6-diphenyl-4-pyridinyl)-[4-[1-(1-methylcyclopropanecarbonyl)piperidin-4-yl]piperazin-1-yl]methanone
CID 24993698
2-cyclopropyl-1-[3-[4-[4-(1-methylcyclopropanecarbonyl)piperazine-1-carbonyl]phenyl]phenyl]ethanone
CID 161221422
[4-(1-hydroxycyclobutanecarbonyl)piperazin-1-yl]-[4-(2-hydroxyindazol-6-yl)phenyl]methanone
CID 139377111
[4-(1-methylcyclopropanecarbonyl)piperazin-1-yl]-[4-[1-(oxetan-3-ylmethyl)indazol-6-yl]phenyl]methanone
CID 158682998
[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-[4-(1-methylcyclopropanecarbonyl)piperazin-1-yl]methanone
CID 162090850
[4-(1-hydroxycyclopropanecarbonyl)piperazin-1-yl]-[4-[4-(1-methyltriazol-4-yl)phenyl]phenyl]methanone
CID 118621731
5-[4-[4-(1-hydroxycyclobutanecarbonyl)piperazine-1-carbonyl]phenyl]-1-benzofuran-3-carbonitrile
CID 139377212

Frequently Asked Questions

What is the IUPAC name of (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone?
The IUPAC name of (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone (CID 160731330) is (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone.
What is the SMILES notation for (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone?
The canonical SMILES for (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone is CC1(C(=O)N2CCN(C(=O)c3ccc(-c4ccc5occc5n4)cc3)CC2)CCC1.
What is the InChIKey of (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone?
The InChIKey is RUJMSOXOXVWROY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-24(10-2-11-24)23(29)27-14-12-26(13-15-27)22(28)18-5-3-17(4-6-18)19-7-8-21-20(25-19)9-16-30-21/h3-9,16H,2,10-15H2,1H3.
What are the key properties of (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone?
(4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone has a molecular weight of 403.48 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-furo[3,2-b]pyridin-5-ylphenyl)-[4-(1-methylcyclobutanecarbonyl)piperazin-1-yl]methanone is sourced from PubChem (CID 160731330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).