4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine

C13H21N3 — CID 79260870

IUPAC4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
SMILESCc1cccc(CN2CCC(C)C(N)C2)n1
InChIInChI=1S/C13H21N3/c1-10-6-7-16(9-13(10)14)8-12-5-3-4-11(2)15-12/h3-5,10,13H,6-9,14H2,1-2H3
InChIKeyWWQCDQVDSHQPIR-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.56
Rot. Bonds2

About 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine

4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine (PubChem CID 79260870) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
PubChem CID79260870
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
SMILESCc1cccc(CN2CCC(C)C(N)C2)n1
InChIInChI=1S/C13H21N3/c1-10-6-7-16(9-13(10)14)8-12-5-3-4-11(2)15-12/h3-5,10,13H,6-9,14H2,1-2H3
InChIKeyWWQCDQVDSHQPIR-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-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
CID 11160034
1-[(6-methyl-2-pyridinyl)methyl]piperidine-3,4-dicarboxylic acid
CID 115918772
[6-[(3,4-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 106907162
4-methyl-1-[(5-methyl-2-pyridinyl)methyl]piperidin-3-amine
CID 81319689
2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine
CID 74234895
(3R)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperazine
CID 104975601
3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepane
CID 64948769
(6S)-1-benzyl-4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-6-ol
CID 97285618
N-[[1-[(6-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methyl]propan-2-amine
CID 62512311
N-[[1-[(6-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methyl]propan-1-amine
CID 62512310
1-[2-(6-methyl-2-pyridinyl)ethyl]azetidin-3-amine
CID 130815160
N-[[1-[(6-methyl-2-pyridinyl)methyl]piperidin-4-yl]methyl]ethanamine
CID 79266938

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The IUPAC name of 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine (CID 79260870) is 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine.
What is the SMILES notation for 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The canonical SMILES for 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine is Cc1cccc(CN2CCC(C)C(N)C2)n1.
What is the InChIKey of 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The InChIKey is WWQCDQVDSHQPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10-6-7-16(9-13(10)14)8-12-5-3-4-11(2)15-12/h3-5,10,13H,6-9,14H2,1-2H3.
What are the key properties of 4-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
4-methyl-1-[(6-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-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine is sourced from PubChem (CID 79260870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).