N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine

C14H23N3 — CID 63853712

IUPACN-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine
SMILESCNC(C)C1CCN(c2ncccc2C)CC1
InChIInChI=1S/C14H23N3/c1-11-5-4-8-16-14(11)17-9-6-13(7-10-17)12(2)15-3/h4-5,8,12-13,15H,6-7,9-10H2,1-3H3
InChIKeyJWQZEPTTWZCGMA-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.21
Rot. Bonds3

About N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine

N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine (PubChem CID 63853712) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine
PubChem CID63853712
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine
SMILESCNC(C)C1CCN(c2ncccc2C)CC1
InChIInChI=1S/C14H23N3/c1-11-5-4-8-16-14(11)17-9-6-13(7-10-17)12(2)15-3/h4-5,8,12-13,15H,6-7,9-10H2,1-3H3
InChIKeyJWQZEPTTWZCGMA-UHFFFAOYSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine?
The IUPAC name of N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine (CID 63853712) is N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine.
What is the SMILES notation for N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine?
The canonical SMILES for N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine is CNC(C)C1CCN(c2ncccc2C)CC1.
What is the InChIKey of N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine?
The InChIKey is JWQZEPTTWZCGMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-11-5-4-8-16-14(11)17-9-6-13(7-10-17)12(2)15-3/h4-5,8,12-13,15H,6-7,9-10H2,1-3H3.
What are the key properties of N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine?
N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine has a molecular weight of 233.36 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]ethanamine is sourced from PubChem (CID 63853712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).