azane;3-methyl-1,2,3,4-tetrahydropyridine

C6H14N2 — CID 174257073

IUPACazane;3-methyl-1,2,3,4-tetrahydropyridine
SMILESCC1CC=CNC1.N
InChIInChI=1S/C6H11N.H3N/c1-6-3-2-4-7-5-6;/h2,4,6-7H,3,5H2,1H3;1H3
InChIKeyHHCZTVHHNIBHBP-UHFFFAOYSA-N
MW114.19 g/mol
LogP1.29
Rot. Bonds

About azane;3-methyl-1,2,3,4-tetrahydropyridine

azane;3-methyl-1,2,3,4-tetrahydropyridine (PubChem CID 174257073) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is azane;3-methyl-1,2,3,4-tetrahydropyridine.

Molecular Properties

Compound Nameazane;3-methyl-1,2,3,4-tetrahydropyridine
PubChem CID174257073
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Nameazane;3-methyl-1,2,3,4-tetrahydropyridine
SMILESCC1CC=CNC1.N
InChIInChI=1S/C6H11N.H3N/c1-6-3-2-4-7-5-6;/h2,4,6-7H,3,5H2,1H3;1H3
InChIKeyHHCZTVHHNIBHBP-UHFFFAOYSA-N
XLogP1.29
TPSA47.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azane;3-methyl-1,2,3,4-tetrahydropyridine?
The IUPAC name of azane;3-methyl-1,2,3,4-tetrahydropyridine (CID 174257073) is azane;3-methyl-1,2,3,4-tetrahydropyridine.
What is the SMILES notation for azane;3-methyl-1,2,3,4-tetrahydropyridine?
The canonical SMILES for azane;3-methyl-1,2,3,4-tetrahydropyridine is CC1CC=CNC1.N.
What is the InChIKey of azane;3-methyl-1,2,3,4-tetrahydropyridine?
The InChIKey is HHCZTVHHNIBHBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N.H3N/c1-6-3-2-4-7-5-6;/h2,4,6-7H,3,5H2,1H3;1H3.
What are the key properties of azane;3-methyl-1,2,3,4-tetrahydropyridine?
azane;3-methyl-1,2,3,4-tetrahydropyridine has a molecular weight of 114.19 g/mol, XLogP of 1.29, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;3-methyl-1,2,3,4-tetrahydropyridine is sourced from PubChem (CID 174257073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).