7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride

C13H17ClN2O2 — CID 178145475

IUPAC7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride
SMILESCc1cnc2c(c1)OC1(CCNCC1)CC2=O.Cl
InChIInChI=1S/C13H16N2O2.ClH/c1-9-6-11-12(15-8-9)10(16)7-13(17-11)2-4-14-5-3-13;/h6,8,14H,2-5,7H2,1H3;1H
InChIKeyPRCSVERTNSYRSP-UHFFFAOYSA-N
MW268.74 g/mol
LogP1.90
Rot. Bonds

About 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride

7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride (PubChem CID 178145475) has the molecular formula C13H17ClN2O2 and a molecular weight of 268.74 g/mol. Its IUPAC name is 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride.

Molecular Properties

Compound Name7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride
PubChem CID178145475
Molecular FormulaC13H17ClN2O2
Molecular Weight268.74 g/mol
Exact Mass268.10
IUPAC Name7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride
SMILESCc1cnc2c(c1)OC1(CCNCC1)CC2=O.Cl
InChIInChI=1S/C13H16N2O2.ClH/c1-9-6-11-12(15-8-9)10(16)7-13(17-11)2-4-14-5-3-13;/h6,8,14H,2-5,7H2,1H3;1H
InChIKeyPRCSVERTNSYRSP-UHFFFAOYSA-N
XLogP1.90
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.74
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

azane;6,7-dimethylspiro[3H-chromene-2,4'-piperidine]-4-one
CID 68979628
6-(trifluoromethyl)spiro[3H-chromene-2,4'-piperidine]-4-one;hydrochloride
CID 68663844
6-chloro-5,7-dimethylspiro[3H-chromene-2,4'-piperidine]-4-one
CID 16643155
6,7-dimethoxyspiro[3H-chromene-2,4'-piperidine]-4-one
CID 66524938
6-fluorospiro[3H-chromene-2,4'-piperidine]-4-one;hydrochloride
CID 68663303
5-methylspiro[3H-1-benzofuran-2,4'-piperidine]
CID 59833648
1,3-dimethylspiro[6H-pyrano[2,3-d]pyrazole-5,4'-piperidine]-7-one;hydrochloride
CID 177063240
6,7-dimethylspiro[3H-chromene-2,3'-pyrrolidine]-4-one
CID 82045683
spiro[2H-benzo[f]chromene-3,4'-piperidine]-1-one
CID 16643166
methyl-(4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)carbamic acid;hydrochloride
CID 66781896
3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one
CID 155891050
spiro[7H-furo[3,2-d]pyrimidine-6,4'-piperidine]
CID 163289339

Frequently Asked Questions

What is the IUPAC name of 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride?
The IUPAC name of 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride (CID 178145475) is 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride.
What is the SMILES notation for 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride?
The canonical SMILES for 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride is Cc1cnc2c(c1)OC1(CCNCC1)CC2=O.Cl.
What is the InChIKey of 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride?
The InChIKey is PRCSVERTNSYRSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2.ClH/c1-9-6-11-12(15-8-9)10(16)7-13(17-11)2-4-14-5-3-13;/h6,8,14H,2-5,7H2,1H3;1H.
What are the key properties of 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride?
7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride has a molecular weight of 268.74 g/mol, XLogP of 1.90, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride is sourced from PubChem (CID 178145475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).