4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide

C12H19N5 — CID 107162294

IUPAC4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide
SMILES[H]/N=C(\N)C1(C)CCN(c2nccnc2C)CC1
InChIInChI=1S/C12H19N5/c1-9-10(16-6-5-15-9)17-7-3-12(2,4-8-17)11(13)14/h5-6H,3-4,7-8H2,1-2H3,(H3,13,14)
InChIKeyWQUDSMSCTTVOET-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.33
Rot. Bonds2

About 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide

4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide (PubChem CID 107162294) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide.

Molecular Properties

Compound Name4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide
PubChem CID107162294
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide
SMILES[H]/N=C(\N)C1(C)CCN(c2nccnc2C)CC1
InChIInChI=1S/C12H19N5/c1-9-10(16-6-5-15-9)17-7-3-12(2,4-8-17)11(13)14/h5-6H,3-4,7-8H2,1-2H3,(H3,13,14)
InChIKeyWQUDSMSCTTVOET-UHFFFAOYSA-N
XLogP1.33
TPSA78.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

4-methyl-1-(3-methylquinoxalin-2-yl)piperidine-4-carboximidamide
CID 107162205
4-methyl-1-(3-oxo-4-propylpyrazin-2-yl)piperidine-4-carboximidamide
CID 107162190
1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-4-methylpiperidine-4-carboximidamide
CID 107162197
4-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboximidamide
CID 107162142
1-[5-bromo-3-(trifluoromethyl)-2-pyridinyl]-4-methylpiperidine-4-carboximidamide
CID 107162239
3-(4-methylpiperazin-1-yl)pyrazine-2-carboximidamide
CID 62683691
2-(7,7-dimethyl-1,4-thiazepan-4-yl)-4-methylpyridine-3-carboximidamide
CID 107455502
1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-4-methylpiperidine-4-carboximidamide
CID 107162068
2-(4-hydroxy-4-methylpiperidin-1-yl)-6-methylpyridine-3-carboximidamide
CID 81096579
1-benzyl-4-methylpiperidine-4-carboximidamide
CID 107162081
1-(1H-imidazol-5-ylsulfonyl)-4-methylpiperidine-4-carboximidamide
CID 107162798
1-[(4-hydroxyphenyl)methyl]-4-methylpiperidine-4-carboximidamide
CID 107162140

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide?
The IUPAC name of 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide (CID 107162294) is 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide.
What is the SMILES notation for 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide?
The canonical SMILES for 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide is [H]/N=C(\N)C1(C)CCN(c2nccnc2C)CC1.
What is the InChIKey of 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide?
The InChIKey is WQUDSMSCTTVOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-9-10(16-6-5-15-9)17-7-3-12(2,4-8-17)11(13)14/h5-6H,3-4,7-8H2,1-2H3,(H3,13,14).
What are the key properties of 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide?
4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide has a molecular weight of 233.32 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide is sourced from PubChem (CID 107162294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).