(6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol

C19H22N2O2 — CID 149160605

IUPAC(6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol
SMILESOCc1ccc(-c2ccc3c(c2)CCC2(CCNCC2)O3)nc1
InChIInChI=1S/C19H22N2O2/c22-13-14-1-3-17(21-12-14)15-2-4-18-16(11-15)5-6-19(23-18)7-9-20-10-8-19/h1-4,11-12,20,22H,5-10,13H2
InChIKeyVABRXVPSZNDOJR-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.69
Rot. Bonds2

About (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol

(6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol (PubChem CID 149160605) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol
PubChem CID149160605
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name(6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol
SMILESOCc1ccc(-c2ccc3c(c2)CCC2(CCNCC2)O3)nc1
InChIInChI=1S/C19H22N2O2/c22-13-14-1-3-17(21-12-14)15-2-4-18-16(11-15)5-6-19(23-18)7-9-20-10-8-19/h1-4,11-12,20,22H,5-10,13H2
InChIKeyVABRXVPSZNDOJR-UHFFFAOYSA-N
XLogP2.69
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol?
The IUPAC name of (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol (CID 149160605) is (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol.
What is the SMILES notation for (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol?
The canonical SMILES for (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol is OCc1ccc(-c2ccc3c(c2)CCC2(CCNCC2)O3)nc1.
What is the InChIKey of (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol?
The InChIKey is VABRXVPSZNDOJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c22-13-14-1-3-17(21-12-14)15-2-4-18-16(11-15)5-6-19(23-18)7-9-20-10-8-19/h1-4,11-12,20,22H,5-10,13H2.
What are the key properties of (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol?
(6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol has a molecular weight of 310.40 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol is sourced from PubChem (CID 149160605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).