furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone

C19H23N3O3 — CID 124831689

IUPACfuran-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone
SMILESC[C@@H]1CN(c2ccccn2)C[C@]12COCCN(C(=O)c1ccco1)C2
InChIInChI=1S/C19H23N3O3/c1-15-11-22(17-6-2-3-7-20-17)13-19(15)12-21(8-10-24-14-19)18(23)16-5-4-9-25-16/h2-7,9,15H,8,10-14H2,1H3/t15-,19-/m1/s1
InChIKeyWZEPSRRNVZYUCG-DNVCBOLYSA-N
MW341.41 g/mol
LogP2.29
Rot. Bonds2

About furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone

furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone (PubChem CID 124831689) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone
PubChem CID124831689
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Namefuran-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone
SMILESC[C@@H]1CN(c2ccccn2)C[C@]12COCCN(C(=O)c1ccco1)C2
InChIInChI=1S/C19H23N3O3/c1-15-11-22(17-6-2-3-7-20-17)13-19(15)12-21(8-10-24-14-19)18(23)16-5-4-9-25-16/h2-7,9,15H,8,10-14H2,1H3/t15-,19-/m1/s1
InChIKeyWZEPSRRNVZYUCG-DNVCBOLYSA-N
XLogP2.29
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone with MolForge

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Launch Full Analysis

Related Compounds

(4R,5S)-4-methyl-10-methylsulfonyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecane
CID 97472428
furan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 759046
furan-2-yl-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)methanone
CID 3233080
furan-3-yl-[(4S,5R)-2-(furan-2-ylmethyl)-4-methyl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone
CID 124831865
[6-[4-(furan-2-carbonyl)piperazin-1-yl]-3-pyridinyl]-morpholin-4-ylmethanone
CID 109153468
pyridin-2-yl-[(5R)-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone
CID 97472293
[2-(morpholine-4-carbonyl)cyclopropyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 109133323
pyridin-4-yl-(2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl)methanone
CID 131640073
1-(furan-2-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 43228329
[(4R)-3,3-difluoro-4-methylpiperidin-1-yl]-(furan-2-yl)methanone
CID 129349488
1-morpholin-4-yl-2-(1-pyridin-2-ylpiperidin-4-yl)ethanone
CID 175648113
[4-(methylamino)oxolan-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 66267143

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone?
The IUPAC name of furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone (CID 124831689) is furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone.
What is the SMILES notation for furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone?
The canonical SMILES for furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone is C[C@@H]1CN(c2ccccn2)C[C@]12COCCN(C(=O)c1ccco1)C2.
What is the InChIKey of furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone?
The InChIKey is WZEPSRRNVZYUCG-DNVCBOLYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-15-11-22(17-6-2-3-7-20-17)13-19(15)12-21(8-10-24-14-19)18(23)16-5-4-9-25-16/h2-7,9,15H,8,10-14H2,1H3/t15-,19-/m1/s1.
What are the key properties of furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone?
furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone has a molecular weight of 341.41 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[(4S,5R)-4-methyl-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecan-10-yl]methanone is sourced from PubChem (CID 124831689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).