6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine

C16H23N5 — CID 170101759

IUPAC6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine
SMILESCc1ncc(-c2cccc(NC3CCNC(C)C3)n2)n1C
InChIInChI=1S/C16H23N5/c1-11-9-13(7-8-17-11)19-16-6-4-5-14(20-16)15-10-18-12(2)21(15)3/h4-6,10-11,13,17H,7-9H2,1-3H3,(H,19,20)
InChIKeyGZGRILRZIMNDFT-UHFFFAOYSA-N
MW285.40 g/mol
LogP2.34
Rot. Bonds3

About 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine

6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine (PubChem CID 170101759) has the molecular formula C16H23N5 and a molecular weight of 285.40 g/mol. Its IUPAC name is 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine
PubChem CID170101759
Molecular FormulaC16H23N5
Molecular Weight285.40 g/mol
Exact Mass285.20
IUPAC Name6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine
SMILESCc1ncc(-c2cccc(NC3CCNC(C)C3)n2)n1C
InChIInChI=1S/C16H23N5/c1-11-9-13(7-8-17-11)19-16-6-4-5-14(20-16)15-10-18-12(2)21(15)3/h4-6,10-11,13,17H,7-9H2,1-3H3,(H,19,20)
InChIKeyGZGRILRZIMNDFT-UHFFFAOYSA-N
XLogP2.34
TPSA54.77 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.40
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine?
The IUPAC name of 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine (CID 170101759) is 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine.
What is the SMILES notation for 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine?
The canonical SMILES for 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine is Cc1ncc(-c2cccc(NC3CCNC(C)C3)n2)n1C.
What is the InChIKey of 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine?
The InChIKey is GZGRILRZIMNDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-11-9-13(7-8-17-11)19-16-6-4-5-14(20-16)15-10-18-12(2)21(15)3/h4-6,10-11,13,17H,7-9H2,1-3H3,(H,19,20).
What are the key properties of 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine?
6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine has a molecular weight of 285.40 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dimethylimidazol-4-yl)-N-(2-methylpiperidin-4-yl)pyridin-2-amine is sourced from PubChem (CID 170101759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).