furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone

C18H21N3O2 — CID 3234982

IUPACfuran-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone
SMILESO=C(c1ccco1)N1CCC2(CC1)CN(Cc1ccncc1)C2
InChIInChI=1S/C18H21N3O2/c22-17(16-2-1-11-23-16)21-9-5-18(6-10-21)13-20(14-18)12-15-3-7-19-8-4-15/h1-4,7-8,11H,5-6,9-10,12-14H2
InChIKeyRNOMAJPQAIPWGT-UHFFFAOYSA-N
MW311.38 g/mol
LogP2.41
Rot. Bonds3

About furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone

furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone (PubChem CID 3234982) has the molecular formula C18H21N3O2 and a molecular weight of 311.38 g/mol. Its IUPAC name is furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone
PubChem CID3234982
Molecular FormulaC18H21N3O2
Molecular Weight311.38 g/mol
Exact Mass311.16
IUPAC Namefuran-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone
SMILESO=C(c1ccco1)N1CCC2(CC1)CN(Cc1ccncc1)C2
InChIInChI=1S/C18H21N3O2/c22-17(16-2-1-11-23-16)21-9-5-18(6-10-21)13-20(14-18)12-15-3-7-19-8-4-15/h1-4,7-8,11H,5-6,9-10,12-14H2
InChIKeyRNOMAJPQAIPWGT-UHFFFAOYSA-N
XLogP2.41
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(5R)-9-(furan-2-carbonyl)-2-(pyridin-4-ylmethyl)-2,9-diazaspiro[4.6]undecan-1-one
CID 98896827
4-[[3-(furan-2-carbonyl)-3,9-diazaspiro[5.5]undecan-9-yl]methyl]benzonitrile
CID 3233444
furan-2-yl-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)methanone
CID 3233080
phenyl 2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonane-7-carboxylate
CID 3235523
3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone
CID 62867411
furan-2-yl-[3-(pyridin-4-ylmethoxymethyl)-2-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 133141429
4-(furan-2-carbonyl)-N-(pyridin-4-ylmethyl)piperazine-1-carboxamide
CID 110706346
[2-benzyl-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-(furan-2-yl)methanone
CID 91924984
furan-2-yl-[2-(4-phenylphenyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone
CID 3232660
furan-2-yl-[(5S)-7-(pyrazine-2-carbonyl)-2,7-diazaspiro[4.5]decan-2-yl]methanone
CID 97370476
2-hydroxy-1-[7-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.4]octan-2-yl]ethanone
CID 97472798
1,4-dioxa-8-azaspiro[4.5]decan-8-yl(furan-2-yl)methanone
CID 2225250

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone?
The IUPAC name of furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone (CID 3234982) is furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone.
What is the SMILES notation for furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone?
The canonical SMILES for furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone is O=C(c1ccco1)N1CCC2(CC1)CN(Cc1ccncc1)C2.
What is the InChIKey of furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone?
The InChIKey is RNOMAJPQAIPWGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c22-17(16-2-1-11-23-16)21-9-5-18(6-10-21)13-20(14-18)12-15-3-7-19-8-4-15/h1-4,7-8,11H,5-6,9-10,12-14H2.
What are the key properties of furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone?
furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone has a molecular weight of 311.38 g/mol, XLogP of 2.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone is sourced from PubChem (CID 3234982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).