6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine

C15H23N3S — CID 166367494

IUPAC6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine
SMILESCc1ccc(C(C)NC2=NCC3CCC(C)CN23)s1
InChIInChI=1S/C15H23N3S/c1-10-4-6-13-8-16-15(18(13)9-10)17-12(3)14-7-5-11(2)19-14/h5,7,10,12-13H,4,6,8-9H2,1-3H3,(H,16,17)
InChIKeyYVSLPHZNYBETOF-UHFFFAOYSA-N
MW277.44 g/mol
LogP3.18
Rot. Bonds2

About 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine

6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine (PubChem CID 166367494) has the molecular formula C15H23N3S and a molecular weight of 277.44 g/mol. Its IUPAC name is 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine.

Molecular Properties

Compound Name6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine
PubChem CID166367494
Molecular FormulaC15H23N3S
Molecular Weight277.44 g/mol
Exact Mass277.16
IUPAC Name6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine
SMILESCc1ccc(C(C)NC2=NCC3CCC(C)CN23)s1
InChIInChI=1S/C15H23N3S/c1-10-4-6-13-8-16-15(18(13)9-10)17-12(3)14-7-5-11(2)19-14/h5,7,10,12-13H,4,6,8-9H2,1-3H3,(H,16,17)
InChIKeyYVSLPHZNYBETOF-UHFFFAOYSA-N
XLogP3.18
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.44
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine;hydroiodide
CID 166367493
6-methyl-N-[1-[5-(trifluoromethyl)thiophen-2-yl]ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine
CID 167957150
N-[1-(4-bromophenyl)ethyl]-6-methyl-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine
CID 166367008
N-[1-(2,6-difluorophenyl)ethyl]-6-methyl-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine
CID 167942426
6-methyl-N-[1-(1-methylpyrazol-3-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine;hydroiodide
CID 166305622
1-cyclopropyl-N-[1-(5-methylthiophen-2-yl)ethyl]pyrrolidin-3-amine
CID 55152081
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-1-(5-methylthiophen-2-yl)ethanamine
CID 54898751
6-N-methyl-2-N-[1-(5-methylthiophen-2-yl)ethyl]pyrazine-2,6-diamine
CID 80800505
N-[1-(5-methylthiophen-2-yl)ethyl]-4-propan-2-yl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 114177187
9-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine
CID 65471234
3-(2-methylpiperidin-1-yl)-N-[1-(5-methylthiophen-2-yl)ethyl]propan-1-amine
CID 43193227
1,1-dimethyl-2-[1-(5-methylthiophen-2-yl)ethyl]hydrazine
CID 83002998

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine?
The IUPAC name of 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine (CID 166367494) is 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine.
What is the SMILES notation for 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine?
The canonical SMILES for 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine is Cc1ccc(C(C)NC2=NCC3CCC(C)CN23)s1.
What is the InChIKey of 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine?
The InChIKey is YVSLPHZNYBETOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3S/c1-10-4-6-13-8-16-15(18(13)9-10)17-12(3)14-7-5-11(2)19-14/h5,7,10,12-13H,4,6,8-9H2,1-3H3,(H,16,17).
What are the key properties of 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine?
6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine has a molecular weight of 277.44 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyridin-3-amine is sourced from PubChem (CID 166367494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).