1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine

C15H23N5 — CID 120969672

IUPAC1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine
SMILESCN1CCN=C1NCc1ccc(N2CCCCC2)nc1
InChIInChI=1S/C15H23N5/c1-19-10-7-16-15(19)18-12-13-5-6-14(17-11-13)20-8-3-2-4-9-20/h5-6,11H,2-4,7-10,12H2,1H3,(H,16,18)
InChIKeyXCJZWWVJUMXHLY-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.46
Rot. Bonds3

About 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine

1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine (PubChem CID 120969672) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine
PubChem CID120969672
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine
SMILESCN1CCN=C1NCc1ccc(N2CCCCC2)nc1
InChIInChI=1S/C15H23N5/c1-19-10-7-16-15(19)18-12-13-5-6-14(17-11-13)20-8-3-2-4-9-20/h5-6,11H,2-4,7-10,12H2,1H3,(H,16,18)
InChIKeyXCJZWWVJUMXHLY-UHFFFAOYSA-N
XLogP1.46
TPSA43.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine (CID 120969672) is 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine is CN1CCN=C1NCc1ccc(N2CCCCC2)nc1.
What is the InChIKey of 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine?
The InChIKey is XCJZWWVJUMXHLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-19-10-7-16-15(19)18-12-13-5-6-14(17-11-13)20-8-3-2-4-9-20/h5-6,11H,2-4,7-10,12H2,1H3,(H,16,18).
What are the key properties of 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine?
1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine has a molecular weight of 273.38 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 120969672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).