2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine

C16H27N3 — CID 63306392

IUPAC2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(Cc2ncccc2C)C(C)C1
InChIInChI=1S/C16H27N3/c1-4-8-17-15-7-10-19(14(3)11-15)12-16-13(2)6-5-9-18-16/h5-6,9,14-15,17H,4,7-8,10-12H2,1-3H3
InChIKeyOBSXOLXMCRNIPJ-UHFFFAOYSA-N
MW261.41 g/mol
LogP2.74
Rot. Bonds5

About 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine

2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine (PubChem CID 63306392) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
PubChem CID63306392
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(Cc2ncccc2C)C(C)C1
InChIInChI=1S/C16H27N3/c1-4-8-17-15-7-10-19(14(3)11-15)12-16-13(2)6-5-9-18-16/h5-6,9,14-15,17H,4,7-8,10-12H2,1-3H3
InChIKeyOBSXOLXMCRNIPJ-UHFFFAOYSA-N
XLogP2.74
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-(1,2,4-oxadiazol-3-ylmethyl)-N-propylpiperidin-4-amine
CID 114184173
1-(3-methyl-2-pyridinyl)-N-propylpiperidin-4-amine
CID 62252971
1-[(6-methoxy-3-pyridinyl)methyl]-2-methyl-N-propylpiperidin-4-amine
CID 62992637
2-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-N-propylpiperidin-4-amine
CID 54976397
N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine
CID 106896358
2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine
CID 104740020
2-methyl-1-[(4-methylcyclohexyl)methyl]-N-propylpiperidin-4-amine
CID 63243811
2-methyl-N-propyl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperidin-4-amine
CID 79358560
[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 103897843
2-methyl-N-propyl-1-(2,2,3,3-tetrafluoropropyl)piperidin-4-amine
CID 106293319
N-ethyl-2-methyl-1-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 114127659
5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine
CID 64940428

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine?
The IUPAC name of 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine (CID 63306392) is 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine.
What is the SMILES notation for 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine?
The canonical SMILES for 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine is CCCNC1CCN(Cc2ncccc2C)C(C)C1.
What is the InChIKey of 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine?
The InChIKey is OBSXOLXMCRNIPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-4-8-17-15-7-10-19(14(3)11-15)12-16-13(2)6-5-9-18-16/h5-6,9,14-15,17H,4,7-8,10-12H2,1-3H3.
What are the key properties of 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine?
2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine has a molecular weight of 261.41 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine is sourced from PubChem (CID 63306392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).