N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine

C7H14N2 — CID 56614411

IUPACN,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine
SMILESCN(C)C1CC=CCN1
InChIInChI=1S/C7H14N2/c1-9(2)7-5-3-4-6-8-7/h3-4,7-8H,5-6H2,1-2H3
InChIKeyGZUUCMSATBXQFJ-UHFFFAOYSA-N
MW126.20 g/mol
LogP0.42
Rot. Bonds1

About N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine

N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine (PubChem CID 56614411) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine
PubChem CID56614411
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine
SMILESCN(C)C1CC=CCN1
InChIInChI=1S/C7H14N2/c1-9(2)7-5-3-4-6-8-7/h3-4,7-8H,5-6H2,1-2H3
InChIKeyGZUUCMSATBXQFJ-UHFFFAOYSA-N
XLogP0.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine?
The IUPAC name of N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine (CID 56614411) is N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine.
What is the SMILES notation for N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine?
The canonical SMILES for N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine is CN(C)C1CC=CCN1.
What is the InChIKey of N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine?
The InChIKey is GZUUCMSATBXQFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-9(2)7-5-3-4-6-8-7/h3-4,7-8H,5-6H2,1-2H3.
What are the key properties of N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine?
N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine has a molecular weight of 126.20 g/mol, XLogP of 0.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1,2,3,6-tetrahydropyridin-2-amine is sourced from PubChem (CID 56614411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).