3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine

C12H16N4 — CID 84681989

IUPAC3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine
SMILESc1cn2c(CC3CCNCC3)ncc2cn1
InChIInChI=1S/C12H16N4/c1-3-13-4-2-10(1)7-12-15-9-11-8-14-5-6-16(11)12/h5-6,8-10,13H,1-4,7H2
InChIKeyKNSAJTYYUJZKAK-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.27
Rot. Bonds2

About 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine

3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine (PubChem CID 84681989) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine
PubChem CID84681989
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine
SMILESc1cn2c(CC3CCNCC3)ncc2cn1
InChIInChI=1S/C12H16N4/c1-3-13-4-2-10(1)7-12-15-9-11-8-14-5-6-16(11)12/h5-6,8-10,13H,1-4,7H2
InChIKeyKNSAJTYYUJZKAK-UHFFFAOYSA-N
XLogP1.27
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-bromo-3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyridine
CID 84743877
N,N-dimethyl-3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyridin-7-amine
CID 84742521
7-methoxy-3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyridine
CID 117142954
3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyridin-8-ol
CID 105489731
4-[(1-propan-2-ylimidazol-2-yl)methyl]piperidine
CID 84734211
4-[(3-ethylimidazol-4-yl)methyl]piperidine
CID 84665127
3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine
CID 62690462
2-phenyl-7-[3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazin-1-yl]quinoline
CID 68629592
2-chloro-3-(piperidin-4-ylmethyl)pyrazine;hydrochloride
CID 171699876
4-[(1-benzyl-5-methylimidazol-2-yl)methyl]piperidine
CID 176515378
6-(piperidin-3-ylmethyl)imidazo[1,5-a]pyrimidine
CID 105470150
7-methyl-3-(piperidin-4-ylmethyl)-[1,2,4]triazolo[4,3-c]pyrimidine
CID 79609021

Frequently Asked Questions

What is the IUPAC name of 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine?
The IUPAC name of 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine (CID 84681989) is 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine.
What is the SMILES notation for 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine?
The canonical SMILES for 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine is c1cn2c(CC3CCNCC3)ncc2cn1.
What is the InChIKey of 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine?
The InChIKey is KNSAJTYYUJZKAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-3-13-4-2-10(1)7-12-15-9-11-8-14-5-6-16(11)12/h5-6,8-10,13H,1-4,7H2.
What are the key properties of 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine?
3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine has a molecular weight of 216.29 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine is sourced from PubChem (CID 84681989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).