N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine

C7H14N2 — CID 57043992

IUPACN,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine
SMILESCN(C)N1CC=CCC1
InChIInChI=1S/C7H14N2/c1-8(2)9-6-4-3-5-7-9/h3-4H,5-7H2,1-2H3
InChIKeyKYASVSCNKOWGCK-UHFFFAOYSA-N
MW126.20 g/mol
LogP0.72
Rot. Bonds1

About N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine

N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine (PubChem CID 57043992) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine
PubChem CID57043992
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine
SMILESCN(C)N1CC=CCC1
InChIInChI=1S/C7H14N2/c1-8(2)9-6-4-3-5-7-9/h3-4H,5-7H2,1-2H3
InChIKeyKYASVSCNKOWGCK-UHFFFAOYSA-N
XLogP0.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.72
H-Bond Donors ≤ 50
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-3,6-dihydro-2H-pyridin-1-amine?
The IUPAC name of N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine (CID 57043992) is N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine.
What is the SMILES notation for N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine?
The canonical SMILES for N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine is CN(C)N1CC=CCC1.
What is the InChIKey of N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine?
The InChIKey is KYASVSCNKOWGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-8(2)9-6-4-3-5-7-9/h3-4H,5-7H2,1-2H3.
What are the key properties of N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine?
N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine has a molecular weight of 126.20 g/mol, XLogP of 0.72, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3,6-dihydro-2H-pyridin-1-amine is sourced from PubChem (CID 57043992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).