4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine

C13H21N3 — CID 81319689

IUPAC4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine
SMILESCc1ccc(CN2CCC(C)C(N)C2)nc1
InChIInChI=1S/C13H21N3/c1-10-3-4-12(15-7-10)8-16-6-5-11(2)13(14)9-16/h3-4,7,11,13H,5-6,8-9,14H2,1-2H3
InChIKeyBTLWOOPBQHGPBG-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.56
Rot. Bonds2

About 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine

4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine (PubChem CID 81319689) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine
PubChem CID81319689
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine
SMILESCc1ccc(CN2CCC(C)C(N)C2)nc1
InChIInChI=1S/C13H21N3/c1-10-3-4-12(15-7-10)8-16-6-5-11(2)13(14)9-16/h3-4,7,11,13H,5-6,8-9,14H2,1-2H3
InChIKeyBTLWOOPBQHGPBG-UHFFFAOYSA-N
XLogP1.56
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[(5-methyl-2-pyridinyl)methyl]piperidin-4-yl]methanamine
CID 81312464
4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
CID 79260870
1-[(5-bromo-2-pyridinyl)methyl]-3-methylpiperidin-4-amine
CID 115741486
N-methyl-1-[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methanamine
CID 81319065
1-[4-[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]piperidin-1-yl]ethanone
CID 91921290
1-[(5-bromo-2-pyridinyl)methyl]-4-methylpiperidin-3-ol
CID 103898383
1-methyl-4-[(5-methyl-2-pyridinyl)methyl]piperazine
CID 20791675
ethane;2-[(3-fluoropyrrolidin-1-yl)methyl]-5-methylpyridine;1-methyl-4-(4-methylphenyl)piperazine
CID 169135139
3-methyl-1-[(5-methyl-2-pyridinyl)methyl]pyrrolidine-2-carboxylic acid
CID 102786635
(3aR,6aS)-5-[(5-methyl-2-pyridinyl)methyl]-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;hydrochloride
CID 120661014
3-[1-[(5-methyl-2-pyridinyl)methyl]piperidin-4-yl]propanoic acid
CID 81320286
[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine
CID 115311630

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The IUPAC name of 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine (CID 81319689) is 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine.
What is the SMILES notation for 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The canonical SMILES for 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine is Cc1ccc(CN2CCC(C)C(N)C2)nc1.
What is the InChIKey of 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The InChIKey is BTLWOOPBQHGPBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10-3-4-12(15-7-10)8-16-6-5-11(2)13(14)9-16/h3-4,7,11,13H,5-6,8-9,14H2,1-2H3.
What are the key properties of 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine?
4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine is sourced from PubChem (CID 81319689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).