spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol

C12H15NO2 — CID 82046047

IUPACspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol
SMILESOc1ccc2c(c1)CCC1(CCNC1)O2
InChIInChI=1S/C12H15NO2/c14-10-1-2-11-9(7-10)3-4-12(15-11)5-6-13-8-12/h1-2,7,13-14H,3-6,8H2
InChIKeyKBXUWFVJZYGQOF-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.45
Rot. Bonds

About spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol

spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol (PubChem CID 82046047) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol.

Molecular Properties

Compound Namespiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol
PubChem CID82046047
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Namespiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol
SMILESOc1ccc2c(c1)CCC1(CCNC1)O2
InChIInChI=1S/C12H15NO2/c14-10-1-2-11-9(7-10)3-4-12(15-11)5-6-13-8-12/h1-2,7,13-14H,3-6,8H2
InChIKeyKBXUWFVJZYGQOF-UHFFFAOYSA-N
XLogP1.45
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]
CID 82046008
6-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine];hydrochloride
CID 121207060
spiro[3,4-dihydro-1,4-benzoxazine-2,1'-cyclohexane]-7-ol
CID 115098139
(2S)-spiro[3,4-dihydrochromene-2,3'-piperidine]
CID 129406410
5-ethylspiro[3H-1-benzofuran-2,3'-pyrrolidine]
CID 170003759
N-hydroxy-N-(6-oxocyclohexa-1,3-dien-1-yl)spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-carboxamide
CID 122624661
8-bromo-6-chlorospiro[3,4-dihydrochromene-2,3'-pyrrolidine]
CID 82046027
spiro[3,4-dihydrochromene-2,4'-piperidine]-5-ol
CID 68756390
5-iodospiro[3H-1-benzofuran-2,4'-piperidine]
CID 13318076
5-methylspiro[3H-1-benzofuran-2,4'-piperidine]
CID 59833648
3,4-dihydro-2H-1,2-benzoxazin-6-ol
CID 66693230
5-fluorospiro[3H-1-benzofuran-2,4'-piperidine];hydrochloride
CID 68958919

Frequently Asked Questions

What is the IUPAC name of spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol?
The IUPAC name of spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol (CID 82046047) is spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol.
What is the SMILES notation for spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol?
The canonical SMILES for spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol is Oc1ccc2c(c1)CCC1(CCNC1)O2.
What is the InChIKey of spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol?
The InChIKey is KBXUWFVJZYGQOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c14-10-1-2-11-9(7-10)3-4-12(15-11)5-6-13-8-12/h1-2,7,13-14H,3-6,8H2.
What are the key properties of spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol?
spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol has a molecular weight of 205.26 g/mol, XLogP of 1.45, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol is sourced from PubChem (CID 82046047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).