3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine

C11H22N2 — CID 58030247

IUPAC3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
SMILESCC(C)C1CCCN2C(C)CNC12
InChIInChI=1S/C11H22N2/c1-8(2)10-5-4-6-13-9(3)7-12-11(10)13/h8-12H,4-7H2,1-3H3
InChIKeyYFDZCDFNDROEQW-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.67
Rot. Bonds1

About 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine

3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine (PubChem CID 58030247) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
PubChem CID58030247
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
SMILESCC(C)C1CCCN2C(C)CNC12
InChIInChI=1S/C11H22N2/c1-8(2)10-5-4-6-13-9(3)7-12-11(10)13/h8-12H,4-7H2,1-3H3
InChIKeyYFDZCDFNDROEQW-UHFFFAOYSA-N
XLogP1.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N1-(2-Amino-4-methylpentyl)octahydro-pyrrolo(1,2-A) pyrimidine
CID 5289474
(4aS,7aS)-6-methyl-octahydro-1H-pyrrolo(3,4-b)pyridine
CID 1519490
1-methyl-octahydro-1H-pyrrolo(3,2-c)pyridine
CID 46176554
cis-1-Methyloctahydropyrrolo[3,4-b]pyridine
CID 59676679
1-methyl-octahydro-1H-pyrrolo(2,3-c)pyridine
CID 68080074
rac-(3aR,7aS)-5-methyl-octahydro-1H-pyrrolo(3,2-c)pyridine
CID 68324704
rac-(3aR,7aS)-1-methyl-octahydro-1H-pyrrolo(2,3-c)pyridine hydrochloride
CID 92844998
(4aS,7aS)-N-(2-methylpropyl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine-6-carboxamide
CID 97377267
3-Isopropyloctahydropyrrolo[1,2-a]pyrazine
CID 71669028
6-Methyloctahydro-1H-pyrrolo[2,3-c]pyridine
CID 59170780
3-Fluoro-2,7-dimethyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
CID 89687897
3-Fluoro-7-methyl-2-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
CID 130205318

Frequently Asked Questions

What is the IUPAC name of 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine?
The IUPAC name of 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine (CID 58030247) is 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine?
The canonical SMILES for 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine is CC(C)C1CCCN2C(C)CNC12.
What is the InChIKey of 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine?
The InChIKey is YFDZCDFNDROEQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-8(2)10-5-4-6-13-9(3)7-12-11(10)13/h8-12H,4-7H2,1-3H3.
What are the key properties of 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine?
3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine has a molecular weight of 182.31 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-8-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 58030247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).