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

C14H23N3 — CID 62895699

IUPAC[3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
SMILESCC1CCCN(Cc2cccnc2CN)C1C
InChIInChI=1S/C14H23N3/c1-11-5-4-8-17(12(11)2)10-13-6-3-7-16-14(13)9-15/h3,6-7,11-12H,4-5,8-10,15H2,1-2H3
InChIKeyQHVITHXGUHMTQE-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.16
Rot. Bonds3

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

[3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine (PubChem CID 62895699) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
PubChem CID62895699
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name[3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
SMILESCC1CCCN(Cc2cccnc2CN)C1C
InChIInChI=1S/C14H23N3/c1-11-5-4-8-17(12(11)2)10-13-6-3-7-16-14(13)9-15/h3,6-7,11-12H,4-5,8-10,15H2,1-2H3
InChIKeyQHVITHXGUHMTQE-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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Frequently Asked Questions

What is the IUPAC name of [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The IUPAC name of [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine (CID 62895699) is [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The canonical SMILES for [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine is CC1CCCN(Cc2cccnc2CN)C1C.
What is the InChIKey of [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The InChIKey is QHVITHXGUHMTQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-11-5-4-8-17(12(11)2)10-13-6-3-7-16-14(13)9-15/h3,6-7,11-12H,4-5,8-10,15H2,1-2H3.
What are the key properties of [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
[3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-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 [3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 62895699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).