N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine

C14H23N3 — CID 117021082

IUPACN,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine
SMILESCNC1CCC(C)(C)N(Cc2cccnc2)C1
InChIInChI=1S/C14H23N3/c1-14(2)7-6-13(15-3)11-17(14)10-12-5-4-8-16-9-12/h4-5,8-9,13,15H,6-7,10-11H2,1-3H3
InChIKeyOAUCYAYUTSEZPK-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.04
Rot. Bonds3

About N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine

N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine (PubChem CID 117021082) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine.

Molecular Properties

Compound NameN,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine
PubChem CID117021082
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine
SMILESCNC1CCC(C)(C)N(Cc2cccnc2)C1
InChIInChI=1S/C14H23N3/c1-14(2)7-6-13(15-3)11-17(14)10-12-5-4-8-16-9-12/h4-5,8-9,13,15H,6-7,10-11H2,1-3H3
InChIKeyOAUCYAYUTSEZPK-UHFFFAOYSA-N
XLogP2.04
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 ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-1-(pyridin-3-ylmethyl)-1,5-diazocane
CID 117014799
8,8-dimethyl-9-(pyridin-3-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64877587
[2,2-dimethyl-1-(pyridin-3-ylmethyl)piperidin-3-yl]methanamine
CID 117019703
3,7-dimethyl-1-(pyridin-3-ylmethyl)-1,4-diazepane
CID 64870565
N-methyl-1-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethanamine
CID 55256845
3-methyl-8-(pyridin-3-ylmethyl)-3,8-diazabicyclo[3.2.1]octane
CID 175732632
4-methyl-3-(methylamino)-1-(pyridin-3-ylmethyl)azepan-2-one
CID 20589951
N-[(1-cyclopropylcyclopropyl)methyl]-1-pyridin-3-ylmethanamine
CID 115757833
N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine
CID 80502656
3,3,6,6-tetramethyl-4-(pyridin-3-ylmethyl)piperazin-2-one
CID 117023878
3-[(3-tert-butylazetidin-1-yl)methyl]pyridine
CID 164785326
3-methyl-1-(pyridin-3-ylmethyl)piperazine
CID 64832187

Frequently Asked Questions

What is the IUPAC name of N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine?
The IUPAC name of N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine (CID 117021082) is N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine.
What is the SMILES notation for N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine?
The canonical SMILES for N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine is CNC1CCC(C)(C)N(Cc2cccnc2)C1.
What is the InChIKey of N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine?
The InChIKey is OAUCYAYUTSEZPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-14(2)7-6-13(15-3)11-17(14)10-12-5-4-8-16-9-12/h4-5,8-9,13,15H,6-7,10-11H2,1-3H3.
What are the key properties of N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine?
N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine has a molecular weight of 233.36 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6,6-trimethyl-1-(pyridin-3-ylmethyl)piperidin-3-amine is sourced from PubChem (CID 117021082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).