[2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine

C14H23N3 — CID 114199075

IUPAC[2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine
SMILESCC1(C)CCCN(Cc2ncccc2CN)C1
InChIInChI=1S/C14H23N3/c1-14(2)6-4-8-17(11-14)10-13-12(9-15)5-3-7-16-13/h3,5,7H,4,6,8-11,15H2,1-2H3
InChIKeyJBKAYCJXEQSKBQ-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.16
Rot. Bonds3

About [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine

[2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine (PubChem CID 114199075) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine
PubChem CID114199075
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name[2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine
SMILESCC1(C)CCCN(Cc2ncccc2CN)C1
InChIInChI=1S/C14H23N3/c1-14(2)6-4-8-17(11-14)10-13-12(9-15)5-3-7-16-13/h3,5,7H,4,6,8-11,15H2,1-2H3
InChIKeyJBKAYCJXEQSKBQ-UHFFFAOYSA-N
XLogP2.16
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 ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(azetidin-1-ylmethyl)-3-pyridinyl]methanamine
CID 105437205
1-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethyl-1,4-diazepane
CID 82745597
[2-[(3,4,5-trimethylpiperazin-1-yl)methyl]-3-pyridinyl]methanamine
CID 114199128
[2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-3-pyridinyl]methanamine
CID 114199079
5-[4-[(3-methyl-2-pyridinyl)methyl]-1,4-diazepan-1-yl]pentan-1-amine
CID 115981865
2-[2-[(3,3-dimethylpiperidin-1-yl)methyl]phenyl]-N-methylethanamine
CID 115464149
[2-[(2,4-dimethyl-1,4-diazepan-1-yl)methyl]-3-pyridinyl]methanamine
CID 114199136
4-[(3,3-dimethylpiperidin-1-yl)methyl]-1-propan-2-ylisoquinoline
CID 170588954
[2-(3,3-dimethylpiperidin-1-yl)-3-fluoro-4-pyridinyl]methanamine
CID 105389976
1-[2-[(2,2-dimethylthiomorpholin-4-yl)methyl]-3-pyridinyl]-N-methylmethanamine
CID 114199123
3,3-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]-1,4-diazepane
CID 64950592
[4-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperidin-4-yl]methanamine
CID 107160723

Frequently Asked Questions

What is the IUPAC name of [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine?
The IUPAC name of [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine (CID 114199075) is [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine.
What is the SMILES notation for [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine?
The canonical SMILES for [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine is CC1(C)CCCN(Cc2ncccc2CN)C1.
What is the InChIKey of [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine?
The InChIKey is JBKAYCJXEQSKBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-14(2)6-4-8-17(11-14)10-13-12(9-15)5-3-7-16-13/h3,5,7H,4,6,8-11,15H2,1-2H3.
What are the key properties of [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine?
[2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine has a molecular weight of 233.36 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3,3-dimethylpiperidin-1-yl)methyl]-3-pyridinyl]methanamine is sourced from PubChem (CID 114199075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).