5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine

C8H16N2 — CID 90723394

IUPAC5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine
SMILESCC1CCC(N)=NC1(C)C
InChIInChI=1S/C8H16N2/c1-6-4-5-7(9)10-8(6,2)3/h6H,4-5H2,1-3H3,(H2,9,10)
InChIKeyBQGNGRBAVNPAKJ-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.55
Rot. Bonds

About 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine

5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine (PubChem CID 90723394) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine.

Molecular Properties

Compound Name5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine
PubChem CID90723394
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine
SMILESCC1CCC(N)=NC1(C)C
InChIInChI=1S/C8H16N2/c1-6-4-5-7(9)10-8(6,2)3/h6H,4-5H2,1-3H3,(H2,9,10)
InChIKeyBQGNGRBAVNPAKJ-UHFFFAOYSA-N
XLogP1.55
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine?
The IUPAC name of 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine (CID 90723394) is 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine.
What is the SMILES notation for 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine?
The canonical SMILES for 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine is CC1CCC(N)=NC1(C)C.
What is the InChIKey of 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine?
The InChIKey is BQGNGRBAVNPAKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-6-4-5-7(9)10-8(6,2)3/h6H,4-5H2,1-3H3,(H2,9,10).
What are the key properties of 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine?
5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine has a molecular weight of 140.23 g/mol, XLogP of 1.55, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,6-trimethyl-4,5-dihydro-3H-pyridin-2-amine is sourced from PubChem (CID 90723394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).