5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine

C13H23N3 — CID 126490058

IUPAC5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine
SMILESCC1=CNC(NCCN2CCCCC2)C=C1
InChIInChI=1S/C13H23N3/c1-12-5-6-13(15-11-12)14-7-10-16-8-3-2-4-9-16/h5-6,11,13-15H,2-4,7-10H2,1H3
InChIKeyGJESBNVNPSUVQH-UHFFFAOYSA-N
MW221.35 g/mol
LogP1.45
Rot. Bonds4

About 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine

5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine (PubChem CID 126490058) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine.

Molecular Properties

Compound Name5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine
PubChem CID126490058
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine
SMILESCC1=CNC(NCCN2CCCCC2)C=C1
InChIInChI=1S/C13H23N3/c1-12-5-6-13(15-11-12)14-7-10-16-8-3-2-4-9-16/h5-6,11,13-15H,2-4,7-10H2,1H3
InChIKeyGJESBNVNPSUVQH-UHFFFAOYSA-N
XLogP1.45
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine?
The IUPAC name of 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine (CID 126490058) is 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine.
What is the SMILES notation for 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine?
The canonical SMILES for 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine is CC1=CNC(NCCN2CCCCC2)C=C1.
What is the InChIKey of 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine?
The InChIKey is GJESBNVNPSUVQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-12-5-6-13(15-11-12)14-7-10-16-8-3-2-4-9-16/h5-6,11,13-15H,2-4,7-10H2,1H3.
What are the key properties of 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine?
5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine has a molecular weight of 221.35 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine is sourced from PubChem (CID 126490058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).