5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine

C15H21N5 — CID 114718674

IUPAC5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine
SMILESNc1ccc(-c2cncn2CCN2CCCCC2)cn1
InChIInChI=1S/C15H21N5/c16-15-5-4-13(10-18-15)14-11-17-12-20(14)9-8-19-6-2-1-3-7-19/h4-5,10-12H,1-3,6-9H2,(H2,16,18)
InChIKeyFQYLHMVMSDNOBA-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.01
Rot. Bonds4

About 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine

5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine (PubChem CID 114718674) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine
PubChem CID114718674
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine
SMILESNc1ccc(-c2cncn2CCN2CCCCC2)cn1
InChIInChI=1S/C15H21N5/c16-15-5-4-13(10-18-15)14-11-17-12-20(14)9-8-19-6-2-1-3-7-19/h4-5,10-12H,1-3,6-9H2,(H2,16,18)
InChIKeyFQYLHMVMSDNOBA-UHFFFAOYSA-N
XLogP2.01
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine?
The IUPAC name of 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine (CID 114718674) is 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine?
The canonical SMILES for 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine is Nc1ccc(-c2cncn2CCN2CCCCC2)cn1.
What is the InChIKey of 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine?
The InChIKey is FQYLHMVMSDNOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c16-15-5-4-13(10-18-15)14-11-17-12-20(14)9-8-19-6-2-1-3-7-19/h4-5,10-12H,1-3,6-9H2,(H2,16,18).
What are the key properties of 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine?
5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine has a molecular weight of 271.37 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 114718674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).