6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine

C15H26N4 — CID 79234659

IUPAC6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine
SMILESCCNc1cccc(CN2CCCC(N(C)C)C2)n1
InChIInChI=1S/C15H26N4/c1-4-16-15-9-5-7-13(17-15)11-19-10-6-8-14(12-19)18(2)3/h5,7,9,14H,4,6,8,10-12H2,1-3H3,(H,16,17)
InChIKeyNKRYZSQYNZVFBS-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.04
Rot. Bonds5

About 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine

6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine (PubChem CID 79234659) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine
PubChem CID79234659
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine
SMILESCCNc1cccc(CN2CCCC(N(C)C)C2)n1
InChIInChI=1S/C15H26N4/c1-4-16-15-9-5-7-13(17-15)11-19-10-6-8-14(12-19)18(2)3/h5,7,9,14H,4,6,8,10-12H2,1-3H3,(H,16,17)
InChIKeyNKRYZSQYNZVFBS-UHFFFAOYSA-N
XLogP2.04
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine?
The IUPAC name of 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine (CID 79234659) is 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine is CCNc1cccc(CN2CCCC(N(C)C)C2)n1.
What is the InChIKey of 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine?
The InChIKey is NKRYZSQYNZVFBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-16-15-9-5-7-13(17-15)11-19-10-6-8-14(12-19)18(2)3/h5,7,9,14H,4,6,8,10-12H2,1-3H3,(H,16,17).
What are the key properties of 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine?
6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine has a molecular weight of 262.40 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 79234659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).