6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride

C21H25Cl2N3O — CID 175982497

IUPAC6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride
SMILESCc1c(-c2ccc3c(c2)CCC2(CCNCC2)O3)ccc2ccnn12.Cl.Cl
InChIInChI=1S/C21H23N3O.2ClH/c1-15-19(4-3-18-7-11-23-24(15)18)16-2-5-20-17(14-16)6-8-21(25-20)9-12-22-13-10-21;;/h2-5,7,11,14,22H,6,8-10,12-13H2,1H3;2*1H
InChIKeyYCGWLWVVDDCRHK-UHFFFAOYSA-N
MW406.36 g/mol
LogP4.60
Rot. Bonds1

About 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride

6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride (PubChem CID 175982497) has the molecular formula C21H25Cl2N3O and a molecular weight of 406.36 g/mol. Its IUPAC name is 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride.

Molecular Properties

Compound Name6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride
PubChem CID175982497
Molecular FormulaC21H25Cl2N3O
Molecular Weight406.36 g/mol
Exact Mass405.14
IUPAC Name6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride
SMILESCc1c(-c2ccc3c(c2)CCC2(CCNCC2)O3)ccc2ccnn12.Cl.Cl
InChIInChI=1S/C21H23N3O.2ClH/c1-15-19(4-3-18-7-11-23-24(15)18)16-2-5-20-17(14-16)6-8-21(25-20)9-12-22-13-10-21;;/h2-5,7,11,14,22H,6,8-10,12-13H2,1H3;2*1H
InChIKeyYCGWLWVVDDCRHK-UHFFFAOYSA-N
XLogP4.60
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.36
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride with MolForge

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Related Compounds

N-ethoxy-6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide
CID 135125282
6-(8-methylquinolin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride
CID 135124849
5-(8-methylquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine];dihydrochloride
CID 175982491
6-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]
CID 82046008
6-[4-(methylsulfonylmethyl)phenyl]spiro[3,4-dihydrochromene-2,4'-piperidine]
CID 158107233
(6-spiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl-3-pyridinyl)methanol
CID 149160605
6-(5-methylimidazo[1,2-a]pyridin-6-yl)-1'-propan-2-yloxyspiro[3,4-dihydrochromene-2,4'-piperidine]
CID 142379803
6-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine];hydrochloride
CID 121207060
5-methylspiro[3H-1-benzofuran-2,4'-piperidine]
CID 59833648
spiro[3,4-dihydrochromene-2,3'-pyrrolidine]-6-ol
CID 82046047
6-(2-methylpropoxy)spiro[3,4-dihydrochromene-2,4'-piperidine]
CID 82045864
6-(8-methylquinolin-7-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carbaldehyde
CID 135141595

Frequently Asked Questions

What is the IUPAC name of 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride?
The IUPAC name of 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride (CID 175982497) is 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride.
What is the SMILES notation for 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride?
The canonical SMILES for 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride is Cc1c(-c2ccc3c(c2)CCC2(CCNCC2)O3)ccc2ccnn12.Cl.Cl.
What is the InChIKey of 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride?
The InChIKey is YCGWLWVVDDCRHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O.2ClH/c1-15-19(4-3-18-7-11-23-24(15)18)16-2-5-20-17(14-16)6-8-21(25-20)9-12-22-13-10-21;;/h2-5,7,11,14,22H,6,8-10,12-13H2,1H3;2*1H.
What are the key properties of 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride?
6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride has a molecular weight of 406.36 g/mol, XLogP of 4.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine];dihydrochloride is sourced from PubChem (CID 175982497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).