3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide

C15H24N4 — CID 83055860

IUPAC3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ncccc1CN1CCCCC1CCC
InChIInChI=1S/C15H24N4/c1-2-6-13-8-3-4-10-19(13)11-12-7-5-9-18-14(12)15(16)17/h5,7,9,13H,2-4,6,8,10-11H2,1H3,(H3,16,17)
InChIKeySLYIHPVUJQYXSK-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.52
Rot. Bonds5

About 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide

3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide (PubChem CID 83055860) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide.

Molecular Properties

Compound Name3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide
PubChem CID83055860
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ncccc1CN1CCCCC1CCC
InChIInChI=1S/C15H24N4/c1-2-6-13-8-3-4-10-19(13)11-12-7-5-9-18-14(12)15(16)17/h5,7,9,13H,2-4,6,8,10-11H2,1H3,(H3,16,17)
InChIKeySLYIHPVUJQYXSK-UHFFFAOYSA-N
XLogP2.52
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

3-(2-propylpiperidin-1-yl)pyridine-2-carboximidamide
CID 83055621
5-fluoro-2-[(2-propylpiperidin-1-yl)methyl]benzenecarboximidamide
CID 83055936
3-[(2-ethylpyrrolidin-1-yl)methyl]pyridine-2-carbothioamide
CID 62894282
3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-ylmethyl)pyridine-2-carboximidamide
CID 79932125
[2-[(2-propylpiperidin-1-yl)methyl]phenyl]methanamine
CID 83053433
3-[(3-hydroxypiperidin-1-yl)methyl]pyridine-2-carboximidamide
CID 62893702
3-[(2-ethylazepan-1-yl)methyl]-2-fluorobenzenecarboximidamide
CID 107118005
3-[(3-hydroxypyrrolidin-1-yl)methyl]pyridine-2-carboximidamide
CID 62943758
3-[(4,4-diethylpiperidin-1-yl)methyl]pyridine-2-carboximidamide
CID 63158312
2-bromo-6-[(2-propylpiperidin-1-yl)methyl]phenol
CID 83057106
3-[(2-ethylimidazol-1-yl)methyl]pyridine-2-carboximidamide
CID 62895246
4-[2-[(2-propylpiperidin-1-yl)methyl]phenyl]but-3-yn-1-ol
CID 83044306

Frequently Asked Questions

What is the IUPAC name of 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide?
The IUPAC name of 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide (CID 83055860) is 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide.
What is the SMILES notation for 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide?
The canonical SMILES for 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide is [H]/N=C(\N)c1ncccc1CN1CCCCC1CCC.
What is the InChIKey of 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide?
The InChIKey is SLYIHPVUJQYXSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-2-6-13-8-3-4-10-19(13)11-12-7-5-9-18-14(12)15(16)17/h5,7,9,13H,2-4,6,8,10-11H2,1H3,(H3,16,17).
What are the key properties of 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide?
3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide has a molecular weight of 260.38 g/mol, XLogP of 2.52, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-propylpiperidin-1-yl)methyl]pyridine-2-carboximidamide is sourced from PubChem (CID 83055860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).