3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C19H30N6 — CID 128507735

IUPAC3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)(C)c1n[nH]c(CN2CCCC(c3ncc4n3CCCC4)C2)n1
InChIInChI=1S/C19H30N6/c1-19(2,3)18-21-16(22-23-18)13-24-9-6-7-14(12-24)17-20-11-15-8-4-5-10-25(15)17/h11,14H,4-10,12-13H2,1-3H3,(H,21,22,23)
InChIKeyWXKAUTCNRPKKHT-UHFFFAOYSA-N
MW342.49 g/mol
LogP3.01
Rot. Bonds3

About 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 128507735) has the molecular formula C19H30N6 and a molecular weight of 342.49 g/mol. Its IUPAC name is 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID128507735
Molecular FormulaC19H30N6
Molecular Weight342.49 g/mol
Exact Mass342.25
IUPAC Name3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)(C)c1n[nH]c(CN2CCCC(c3ncc4n3CCCC4)C2)n1
InChIInChI=1S/C19H30N6/c1-19(2,3)18-21-16(22-23-18)13-24-9-6-7-14(12-24)17-20-11-15-8-4-5-10-25(15)17/h11,14H,4-10,12-13H2,1-3H3,(H,21,22,23)
InChIKeyWXKAUTCNRPKKHT-UHFFFAOYSA-N
XLogP3.01
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.49
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine with MolForge

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Related Compounds

3-(1-propan-2-ylpyrrolidin-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117148268
3-(1-ethylpyrrolidin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117148513
(2R)-2-ethoxy-1-[(3S)-3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propan-1-one
CID 124874961
[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]methanone
CID 139013164
N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine
CID 126805656
3-[[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]methyl]benzoic acid
CID 122033665
3-[1-[(4-fluorophenyl)methyl]piperidin-3-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
CID 71942908
2-(1-methylpiperidin-4-yl)oxy-1-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]ethanone
CID 154867623
4-nitro-3-[(3R)-3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]aniline
CID 125141397
6-tert-butyl-2-[2-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-ylmethyl)piperazin-1-yl]ethyl]pyridazin-3-one
CID 126914181
7-[[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 166265298
1-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]prop-2-en-1-one
CID 138989228

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 128507735) is 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC(C)(C)c1n[nH]c(CN2CCCC(c3ncc4n3CCCC4)C2)n1.
What is the InChIKey of 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is WXKAUTCNRPKKHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N6/c1-19(2,3)18-21-16(22-23-18)13-24-9-6-7-14(12-24)17-20-11-15-8-4-5-10-25(15)17/h11,14H,4-10,12-13H2,1-3H3,(H,21,22,23).
What are the key properties of 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 342.49 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(3-tert-butyl-1H-1,2,4-triazol-5-yl)methyl]piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 128507735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).