4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine

C14H23N3 — CID 62464715

IUPAC4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine
SMILESCNc1cc(CN2CCC(C)CC2C)ccn1
InChIInChI=1S/C14H23N3/c1-11-5-7-17(12(2)8-11)10-13-4-6-16-14(9-13)15-3/h4,6,9,11-12H,5,7-8,10H2,1-3H3,(H,15,16)
InChIKeyAPHOPGXZECDZPZ-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.74
Rot. Bonds3

About 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine

4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine (PubChem CID 62464715) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine
PubChem CID62464715
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine
SMILESCNc1cc(CN2CCC(C)CC2C)ccn1
InChIInChI=1S/C14H23N3/c1-11-5-7-17(12(2)8-11)10-13-4-6-16-14(9-13)15-3/h4,6,9,11-12H,5,7-8,10H2,1-3H3,(H,15,16)
InChIKeyAPHOPGXZECDZPZ-UHFFFAOYSA-N
XLogP2.74
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine (CID 62464715) is 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine is CNc1cc(CN2CCC(C)CC2C)ccn1.
What is the InChIKey of 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine?
The InChIKey is APHOPGXZECDZPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-11-5-7-17(12(2)8-11)10-13-4-6-16-14(9-13)15-3/h4,6,9,11-12H,5,7-8,10H2,1-3H3,(H,15,16).
What are the key properties of 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine?
4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine has a molecular weight of 233.36 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 62464715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).