1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine

C12H24N2 — CID 118190709

IUPAC1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine
SMILESCCN1CC=C(C(C)C)C(N(C)C)C1
InChIInChI=1S/C12H24N2/c1-6-14-8-7-11(10(2)3)12(9-14)13(4)5/h7,10,12H,6,8-9H2,1-5H3
InChIKeyDJEDLZUOHXNDIY-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.83
Rot. Bonds3

About 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine

1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine (PubChem CID 118190709) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine.

Molecular Properties

Compound Name1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine
PubChem CID118190709
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine
SMILESCCN1CC=C(C(C)C)C(N(C)C)C1
InChIInChI=1S/C12H24N2/c1-6-14-8-7-11(10(2)3)12(9-14)13(4)5/h7,10,12H,6,8-9H2,1-5H3
InChIKeyDJEDLZUOHXNDIY-UHFFFAOYSA-N
XLogP1.83
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.83
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 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine?
The IUPAC name of 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine (CID 118190709) is 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine.
What is the SMILES notation for 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine?
The canonical SMILES for 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine is CCN1CC=C(C(C)C)C(N(C)C)C1.
What is the InChIKey of 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine?
The InChIKey is DJEDLZUOHXNDIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-6-14-8-7-11(10(2)3)12(9-14)13(4)5/h7,10,12H,6,8-9H2,1-5H3.
What are the key properties of 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine?
1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine has a molecular weight of 196.34 g/mol, XLogP of 1.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N,N-dimethyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-3-amine is sourced from PubChem (CID 118190709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).