2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine

C11H19N3 — CID 86340531

IUPAC2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine
SMILESCC1CCN(C2C=CC(N)=CN2)CC1
InChIInChI=1S/C11H19N3/c1-9-4-6-14(7-5-9)11-3-2-10(12)8-13-11/h2-3,8-9,11,13H,4-7,12H2,1H3
InChIKeyMFXYJZKBHPHALB-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.00
Rot. Bonds1

About 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine

2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine (PubChem CID 86340531) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine.

Molecular Properties

Compound Name2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine
PubChem CID86340531
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine
SMILESCC1CCN(C2C=CC(N)=CN2)CC1
InChIInChI=1S/C11H19N3/c1-9-4-6-14(7-5-9)11-3-2-10(12)8-13-11/h2-3,8-9,11,13H,4-7,12H2,1H3
InChIKeyMFXYJZKBHPHALB-UHFFFAOYSA-N
XLogP1.00
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine?
The IUPAC name of 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine (CID 86340531) is 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine.
What is the SMILES notation for 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine?
The canonical SMILES for 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine is CC1CCN(C2C=CC(N)=CN2)CC1.
What is the InChIKey of 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine?
The InChIKey is MFXYJZKBHPHALB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-9-4-6-14(7-5-9)11-3-2-10(12)8-13-11/h2-3,8-9,11,13H,4-7,12H2,1H3.
What are the key properties of 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine?
2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine has a molecular weight of 193.29 g/mol, XLogP of 1.00, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-amine is sourced from PubChem (CID 86340531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).