N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride

C19H24Cl2N4O — CID 175654404

IUPACN-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride
SMILESCOc1cccc(Nc2nc(C3CCCNC3)c3ccccn23)c1.Cl.Cl
InChIInChI=1S/C19H22N4O.2ClH/c1-24-16-8-4-7-15(12-16)21-19-22-18(14-6-5-10-20-13-14)17-9-2-3-11-23(17)19;;/h2-4,7-9,11-12,14,20H,5-6,10,13H2,1H3,(H,21,22);2*1H
InChIKeyPYGWVWYEIVPKJS-UHFFFAOYSA-N
MW395.33 g/mol
LogP4.40
Rot. Bonds4

About N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride

N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride (PubChem CID 175654404) has the molecular formula C19H24Cl2N4O and a molecular weight of 395.33 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride
PubChem CID175654404
Molecular FormulaC19H24Cl2N4O
Molecular Weight395.33 g/mol
Exact Mass394.13
IUPAC NameN-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride
SMILESCOc1cccc(Nc2nc(C3CCCNC3)c3ccccn23)c1.Cl.Cl
InChIInChI=1S/C19H22N4O.2ClH/c1-24-16-8-4-7-15(12-16)21-19-22-18(14-6-5-10-20-13-14)17-9-2-3-11-23(17)19;;/h2-4,7-9,11-12,14,20H,5-6,10,13H2,1H3,(H,21,22);2*1H
InChIKeyPYGWVWYEIVPKJS-UHFFFAOYSA-N
XLogP4.40
TPSA50.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.33
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride?
The IUPAC name of N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride (CID 175654404) is N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride.
What is the SMILES notation for N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride?
The canonical SMILES for N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride is COc1cccc(Nc2nc(C3CCCNC3)c3ccccn23)c1.Cl.Cl.
What is the InChIKey of N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride?
The InChIKey is PYGWVWYEIVPKJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O.2ClH/c1-24-16-8-4-7-15(12-16)21-19-22-18(14-6-5-10-20-13-14)17-9-2-3-11-23(17)19;;/h2-4,7-9,11-12,14,20H,5-6,10,13H2,1H3,(H,21,22);2*1H.
What are the key properties of N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride?
N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride has a molecular weight of 395.33 g/mol, XLogP of 4.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-1-piperidin-3-ylimidazo[1,5-a]pyridin-3-amine;dihydrochloride is sourced from PubChem (CID 175654404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).