2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine

C12H21N3 — CID 175362543

IUPAC2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine
SMILESCC1(C)CCN(C2(N)C=CC=CN2)CC1
InChIInChI=1S/C12H21N3/c1-11(2)6-9-15(10-7-11)12(13)5-3-4-8-14-12/h3-5,8,14H,6-7,9-10,13H2,1-2H3
InChIKeyFPOZSVNPWKQQRU-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.39
Rot. Bonds1

About 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine

2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine (PubChem CID 175362543) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine.

Molecular Properties

Compound Name2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine
PubChem CID175362543
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine
SMILESCC1(C)CCN(C2(N)C=CC=CN2)CC1
InChIInChI=1S/C12H21N3/c1-11(2)6-9-15(10-7-11)12(13)5-3-4-8-14-12/h3-5,8,14H,6-7,9-10,13H2,1-2H3
InChIKeyFPOZSVNPWKQQRU-UHFFFAOYSA-N
XLogP1.39
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine?
The IUPAC name of 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine (CID 175362543) is 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine.
What is the SMILES notation for 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine?
The canonical SMILES for 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine is CC1(C)CCN(C2(N)C=CC=CN2)CC1.
What is the InChIKey of 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine?
The InChIKey is FPOZSVNPWKQQRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-11(2)6-9-15(10-7-11)12(13)5-3-4-8-14-12/h3-5,8,14H,6-7,9-10,13H2,1-2H3.
What are the key properties of 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine?
2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine has a molecular weight of 207.32 g/mol, XLogP of 1.39, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethylpiperidin-1-yl)-1H-pyridin-2-amine is sourced from PubChem (CID 175362543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).