N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine

C11H20N2O — CID 130699308

IUPACN-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine
SMILESCC1(C)OCCC1NC1=NCCCC1
InChIInChI=1S/C11H20N2O/c1-11(2)9(6-8-14-11)13-10-5-3-4-7-12-10/h9H,3-8H2,1-2H3,(H,12,13)
InChIKeyLDTRCGOQJRSWBG-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.73
Rot. Bonds1

About N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine

N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine (PubChem CID 130699308) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine.

Molecular Properties

Compound NameN-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine
PubChem CID130699308
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine
SMILESCC1(C)OCCC1NC1=NCCCC1
InChIInChI=1S/C11H20N2O/c1-11(2)9(6-8-14-11)13-10-5-3-4-7-12-10/h9H,3-8H2,1-2H3,(H,12,13)
InChIKeyLDTRCGOQJRSWBG-UHFFFAOYSA-N
XLogP1.73
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine?
The IUPAC name of N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine (CID 130699308) is N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine.
What is the SMILES notation for N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine?
The canonical SMILES for N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine is CC1(C)OCCC1NC1=NCCCC1.
What is the InChIKey of N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine?
The InChIKey is LDTRCGOQJRSWBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-11(2)9(6-8-14-11)13-10-5-3-4-7-12-10/h9H,3-8H2,1-2H3,(H,12,13).
What are the key properties of N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine?
N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine has a molecular weight of 196.29 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxolan-3-yl)-2,3,4,5-tetrahydropyridin-6-amine is sourced from PubChem (CID 130699308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).