8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine

C13H18N4 — CID 58525287

IUPAC8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine
SMILESCc1nccn2cc(C[C@@H]3CCCCN3)nc12
InChIInChI=1S/C13H18N4/c1-10-13-16-12(9-17(13)7-6-14-10)8-11-4-2-3-5-15-11/h6-7,9,11,15H,2-5,8H2,1H3/t11-/m0/s1
InChIKeyDIPGHCSQGHOLTB-NSHDSACASA-N
MW230.31 g/mol
LogP1.72
Rot. Bonds2

About 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine

8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine (PubChem CID 58525287) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine
PubChem CID58525287
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine
SMILESCc1nccn2cc(C[C@@H]3CCCCN3)nc12
InChIInChI=1S/C13H18N4/c1-10-13-16-12(9-17(13)7-6-14-10)8-11-4-2-3-5-15-11/h6-7,9,11,15H,2-5,8H2,1H3/t11-/m0/s1
InChIKeyDIPGHCSQGHOLTB-NSHDSACASA-N
XLogP1.72
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrimidine
CID 66650352
[2-(piperidin-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117134516
2-[(1-methylimidazol-4-yl)methyl]piperidine
CID 130509272
2-(piperidin-2-ylmethyl)imidazo[1,2-a]pyridine-7-carbaldehyde
CID 117134530
methyl 2-(piperidin-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxylate
CID 117130008
2-methyl-3-[[(2S)-piperidin-2-yl]methylsulfonyl]pyrazine
CID 97162673
2-[(1-ethyltriazol-4-yl)methyl]piperidine
CID 115020003
1-methyl-2-(pyrrolidin-2-ylmethyl)imidazole;hydrochloride
CID 71298900
3,6,7,8-tetramethyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyridine
CID 58477959
4-(piperidin-2-ylmethyl)-2-propyl-1,3-thiazole
CID 116888787
3-methyl-2-(piperidin-2-ylmethyl)pyridine
CID 4715233
4-(piperidin-2-ylmethyl)-2-pyridin-2-yl-1,3-thiazole
CID 116888793

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine?
The IUPAC name of 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine (CID 58525287) is 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine.
What is the SMILES notation for 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine?
The canonical SMILES for 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine is Cc1nccn2cc(C[C@@H]3CCCCN3)nc12.
What is the InChIKey of 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine?
The InChIKey is DIPGHCSQGHOLTB-NSHDSACASA-N. The full InChI is InChI=1S/C13H18N4/c1-10-13-16-12(9-17(13)7-6-14-10)8-11-4-2-3-5-15-11/h6-7,9,11,15H,2-5,8H2,1H3/t11-/m0/s1.
What are the key properties of 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine?
8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine has a molecular weight of 230.31 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyrazine is sourced from PubChem (CID 58525287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).