3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine

C14H23N3 — CID 120775808

IUPAC3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine
SMILESCC1(C)CN(CCc2cccnc2)CCC1N
InChIInChI=1S/C14H23N3/c1-14(2)11-17(9-6-13(14)15)8-5-12-4-3-7-16-10-12/h3-4,7,10,13H,5-6,8-9,11,15H2,1-2H3
InChIKeyITQZJDXIIWEMDL-UHFFFAOYSA-N
MW233.36 g/mol
LogP1.68
Rot. Bonds3

About 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine

3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine (PubChem CID 120775808) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine
PubChem CID120775808
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine
SMILESCC1(C)CN(CCc2cccnc2)CCC1N
InChIInChI=1S/C14H23N3/c1-14(2)11-17(9-6-13(14)15)8-5-12-4-3-7-16-10-12/h3-4,7,10,13H,5-6,8-9,11,15H2,1-2H3
InChIKeyITQZJDXIIWEMDL-UHFFFAOYSA-N
XLogP1.68
TPSA42.15 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 ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3,3-dimethyl-1-(pyridin-3-ylmethyl)piperidin-4-yl]methanol
CID 117024926
3,3-dimethyl-1-[2-(4-methylphenyl)ethyl]piperidin-4-amine;hydrochloride
CID 120776449
1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]ethanamine;dihydrochloride
CID 119920848
3,3-dimethyl-1-(2-pyridin-3-ylethyl)-1,4-diazepane
CID 64943019
1-[2-(4-methoxyphenyl)ethyl]-3,3-dimethylpiperidin-4-amine
CID 120775320
3-(2-pyrrolidin-1-ylethyl)pyridine
CID 23273673
1-propyl-4-(2-pyridin-3-ylethyl)piperazine
CID 171561190
3,3-dimethyl-1-(2-phenylethyl)piperidine-4-carbonitrile
CID 117024510
7-(2-pyridin-3-ylethyl)-4,7-diazaspiro[2.5]octane
CID 134406396
3,3-dimethyl-1-[(3-pyridin-3-yl-1H-pyrazol-5-yl)methyl]piperidin-4-amine
CID 120782235
3-[4-(2-pyridin-3-ylethyl)piperazin-1-yl]propan-1-amine
CID 55168058
2-[1-(2-pyridin-3-ylethyl)pyrrolidin-3-yl]ethanol
CID 115647965

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine?
The IUPAC name of 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine (CID 120775808) is 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine.
What is the SMILES notation for 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine?
The canonical SMILES for 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine is CC1(C)CN(CCc2cccnc2)CCC1N.
What is the InChIKey of 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine?
The InChIKey is ITQZJDXIIWEMDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-14(2)11-17(9-6-13(14)15)8-5-12-4-3-7-16-10-12/h3-4,7,10,13H,5-6,8-9,11,15H2,1-2H3.
What are the key properties of 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine?
3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(2-pyridin-3-ylethyl)piperidin-4-amine is sourced from PubChem (CID 120775808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).