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

C16H27N3 — CID 117150169

IUPAC3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCCN1CCCC(Cc2ncc3n2C(C)CCC3)C1
InChIInChI=1S/C16H27N3/c1-3-18-9-5-7-14(12-18)10-16-17-11-15-8-4-6-13(2)19(15)16/h11,13-14H,3-10,12H2,1-2H3
InChIKeyOMHXCEVOAFVTHA-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.05
Rot. Bonds3

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

3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 117150169) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID117150169
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCCN1CCCC(Cc2ncc3n2C(C)CCC3)C1
InChIInChI=1S/C16H27N3/c1-3-18-9-5-7-14(12-18)10-16-17-11-15-8-4-6-13(2)19(15)16/h11,13-14H,3-10,12H2,1-2H3
InChIKeyOMHXCEVOAFVTHA-UHFFFAOYSA-N
XLogP3.05
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 117150169) is 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CCN1CCCC(Cc2ncc3n2C(C)CCC3)C1.
What is the InChIKey of 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is OMHXCEVOAFVTHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-3-18-9-5-7-14(12-18)10-16-17-11-15-8-4-6-13(2)19(15)16/h11,13-14H,3-10,12H2,1-2H3.
What are the key properties of 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 261.41 g/mol, XLogP of 3.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-ethylpiperidin-3-yl)methyl]-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 117150169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).