[3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol

C16H27N3O — CID 117148104

IUPAC[3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol
SMILESCCN1CCCC(Cc2ncc3n2CC(CO)CC3)C1
InChIInChI=1S/C16H27N3O/c1-2-18-7-3-4-13(10-18)8-16-17-9-15-6-5-14(12-20)11-19(15)16/h9,13-14,20H,2-8,10-12H2,1H3
InChIKeyPARONXDYJWMWMB-UHFFFAOYSA-N
MW277.41 g/mol
LogP1.71
Rot. Bonds4

About [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol

[3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol (PubChem CID 117148104) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol.

Molecular Properties

Compound Name[3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol
PubChem CID117148104
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name[3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol
SMILESCCN1CCCC(Cc2ncc3n2CC(CO)CC3)C1
InChIInChI=1S/C16H27N3O/c1-2-18-7-3-4-13(10-18)8-16-17-9-15-6-5-14(12-20)11-19(15)16/h9,13-14,20H,2-8,10-12H2,1H3
InChIKeyPARONXDYJWMWMB-UHFFFAOYSA-N
XLogP1.71
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol?
The IUPAC name of [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol (CID 117148104) is [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol.
What is the SMILES notation for [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol?
The canonical SMILES for [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol is CCN1CCCC(Cc2ncc3n2CC(CO)CC3)C1.
What is the InChIKey of [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol?
The InChIKey is PARONXDYJWMWMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-2-18-7-3-4-13(10-18)8-16-17-9-15-6-5-14(12-20)11-19(15)16/h9,13-14,20H,2-8,10-12H2,1H3.
What are the key properties of [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol?
[3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol has a molecular weight of 277.41 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]methanol is sourced from PubChem (CID 117148104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).