2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine

C13H21N3 — CID 104740020

IUPAC2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine
SMILESCC1CCN(Cc2ncccc2N)C(C)C1
InChIInChI=1S/C13H21N3/c1-10-5-7-16(11(2)8-10)9-13-12(14)4-3-6-15-13/h3-4,6,10-11H,5,7-9,14H2,1-2H3
InChIKeyPYMQRCJBWZUGLE-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.28
Rot. Bonds2

About 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine

2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine (PubChem CID 104740020) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine
PubChem CID104740020
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine
SMILESCC1CCN(Cc2ncccc2N)C(C)C1
InChIInChI=1S/C13H21N3/c1-10-5-7-16(11(2)8-10)9-13-12(14)4-3-6-15-13/h3-4,6,10-11H,5,7-9,14H2,1-2H3
InChIKeyPYMQRCJBWZUGLE-UHFFFAOYSA-N
XLogP2.28
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 ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-methylpyrrolidin-1-yl)methyl]pyridin-3-amine
CID 104739860
2-[(2,6-dimethylpiperidin-1-yl)methyl]pyridin-3-amine
CID 104739730
3-[(2,4-dimethylpiperidin-1-yl)methyl]pyridine-2-carboxylic acid
CID 55145764
5-chloro-6-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-2-amine
CID 62892563
[4-[(2,4-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888056
2-[2-(2,4-dimethylpiperidin-1-yl)ethyl]aniline
CID 62496588
[4-[(2,4-dimethylpiperidin-1-yl)methyl]phenyl]-trimethylsilane
CID 103438410
[5-[(2,4-dimethylpiperidin-1-yl)methyl]furan-2-yl]methanamine
CID 62429634
2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
CID 63306392
4-chloro-2-[(2,4-dimethylpiperidin-1-yl)methyl]aniline
CID 79582479
2-[(3-tert-butylpyrrolidin-1-yl)methyl]pyridin-3-amine
CID 104740262
4-[(2,4-dimethylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine
CID 62464715

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine?
The IUPAC name of 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine (CID 104740020) is 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine?
The canonical SMILES for 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine is CC1CCN(Cc2ncccc2N)C(C)C1.
What is the InChIKey of 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine?
The InChIKey is PYMQRCJBWZUGLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10-5-7-16(11(2)8-10)9-13-12(14)4-3-6-15-13/h3-4,6,10-11H,5,7-9,14H2,1-2H3.
What are the key properties of 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine?
2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 104740020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).