1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine

C12H21N3 — CID 173024564

IUPAC1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine
SMILESCN(C)C1CCN(C2C=CC=CN2)CC1
InChIInChI=1S/C12H21N3/c1-14(2)11-6-9-15(10-7-11)12-5-3-4-8-13-12/h3-5,8,11-13H,6-7,9-10H2,1-2H3
InChIKeyZVVMABCFLBZOFO-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.01
Rot. Bonds2

About 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine

1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine (PubChem CID 173024564) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine
PubChem CID173024564
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine
SMILESCN(C)C1CCN(C2C=CC=CN2)CC1
InChIInChI=1S/C12H21N3/c1-14(2)11-6-9-15(10-7-11)12-5-3-4-8-13-12/h3-5,8,11-13H,6-7,9-10H2,1-2H3
InChIKeyZVVMABCFLBZOFO-UHFFFAOYSA-N
XLogP1.01
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine (CID 173024564) is 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine is CN(C)C1CCN(C2C=CC=CN2)CC1.
What is the InChIKey of 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine?
The InChIKey is ZVVMABCFLBZOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-14(2)11-6-9-15(10-7-11)12-5-3-4-8-13-12/h3-5,8,11-13H,6-7,9-10H2,1-2H3.
What are the key properties of 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine?
1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine has a molecular weight of 207.32 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 173024564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).