spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]

C9H15NO — CID 112714159

IUPACspiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]
SMILESC1CC2COCC3(CC3)C2N1
InChIInChI=1S/C9H15NO/c1-4-10-8-7(1)5-11-6-9(8)2-3-9/h7-8,10H,1-6H2
InChIKeyFXHVFVFXTLQTGC-UHFFFAOYSA-N
MW153.22 g/mol
LogP0.77
Rot. Bonds

About spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]

spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane] (PubChem CID 112714159) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane].

Molecular Properties

Compound Namespiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]
PubChem CID112714159
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Namespiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]
SMILESC1CC2COCC3(CC3)C2N1
InChIInChI=1S/C9H15NO/c1-4-10-8-7(1)5-11-6-9(8)2-3-9/h7-8,10H,1-6H2
InChIKeyFXHVFVFXTLQTGC-UHFFFAOYSA-N
XLogP0.77
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane] with MolForge

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Launch Full Analysis

Related Compounds

(3aS,6S,6aR)-6-methyl-2,3,3a,4,5,6a-hexahydro-1H-cyclopenta[b]pyrrol-6-ol
CID 170098111
3,3a,4,5,6,7,8,8a-octahydro-1H-furo[3,4-d]azepine
CID 83669058
(4R)-4-methyl-2-oxa-8-azaspiro[4.5]decane
CID 89206971
3-piperidin-4-yl-2-azaspiro[3.3]heptane
CID 134968782
1,2,3,3a,4,5,7,7a-octahydropyrano[3,4-b]pyrrole
CID 68902591
(3S)-spiro[2,3,3a,4,6,7a-hexahydrofuro[3,2-c]pyran-7,1'-cyclopropane]-3-ol
CID 149320064
2-cyclohexyl-3-fluoro-3-methylpyrrolidine
CID 84718947
2-cycloheptyl-3-fluoro-3-methylpiperidine
CID 84723550
7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrrolo[3,2-c]pyridine
CID 167138391
2-oxa-9-azaspiro[4.5]decan-6-ol
CID 82415907
tert-butyl N-[(4R)-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate
CID 155904737
2-oxaspiro[3.4]octan-5-ol
CID 178199967

Frequently Asked Questions

What is the IUPAC name of spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]?
The IUPAC name of spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane] (CID 112714159) is spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane].
What is the SMILES notation for spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]?
The canonical SMILES for spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane] is C1CC2COCC3(CC3)C2N1.
What is the InChIKey of spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]?
The InChIKey is FXHVFVFXTLQTGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-4-10-8-7(1)5-11-6-9(8)2-3-9/h7-8,10H,1-6H2.
What are the key properties of spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane]?
spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane] has a molecular weight of 153.22 g/mol, XLogP of 0.77, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2,3,3a,4,6,7a-hexahydro-1H-pyrano[4,3-b]pyrrole-7,1'-cyclopropane] is sourced from PubChem (CID 112714159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).