6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine

C15H25N3 — CID 106643185

IUPAC6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
SMILESCc1cccc(N(CC2CCCNC2)C(C)C)n1
InChIInChI=1S/C15H25N3/c1-12(2)18(11-14-7-5-9-16-10-14)15-8-4-6-13(3)17-15/h4,6,8,12,14,16H,5,7,9-11H2,1-3H3
InChIKeyHGTIHPVFMRICJI-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.60
Rot. Bonds4

About 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine

6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine (PubChem CID 106643185) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
PubChem CID106643185
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine
SMILESCc1cccc(N(CC2CCCNC2)C(C)C)n1
InChIInChI=1S/C15H25N3/c1-12(2)18(11-14-7-5-9-16-10-14)15-8-4-6-13(3)17-15/h4,6,8,12,14,16H,5,7,9-11H2,1-3H3
InChIKeyHGTIHPVFMRICJI-UHFFFAOYSA-N
XLogP2.60
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine?
The IUPAC name of 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine (CID 106643185) is 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine is Cc1cccc(N(CC2CCCNC2)C(C)C)n1.
What is the InChIKey of 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine?
The InChIKey is HGTIHPVFMRICJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-12(2)18(11-14-7-5-9-16-10-14)15-8-4-6-13(3)17-15/h4,6,8,12,14,16H,5,7,9-11H2,1-3H3.
What are the key properties of 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine?
6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 106643185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).