3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine

C8H16N2 — CID 146427332

IUPAC3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine
SMILESCC1=CNCC(C)(C)C1N
InChIInChI=1S/C8H16N2/c1-6-4-10-5-8(2,3)7(6)9/h4,7,10H,5,9H2,1-3H3
InChIKeyJXVQJBCILUJDGO-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.85
Rot. Bonds

About 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine

3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine (PubChem CID 146427332) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine.

Molecular Properties

Compound Name3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine
PubChem CID146427332
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine
SMILESCC1=CNCC(C)(C)C1N
InChIInChI=1S/C8H16N2/c1-6-4-10-5-8(2,3)7(6)9/h4,7,10H,5,9H2,1-3H3
InChIKeyJXVQJBCILUJDGO-UHFFFAOYSA-N
XLogP0.85
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine?
The IUPAC name of 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine (CID 146427332) is 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine.
What is the SMILES notation for 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine?
The canonical SMILES for 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine is CC1=CNCC(C)(C)C1N.
What is the InChIKey of 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine?
The InChIKey is JXVQJBCILUJDGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-6-4-10-5-8(2,3)7(6)9/h4,7,10H,5,9H2,1-3H3.
What are the key properties of 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine?
3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine has a molecular weight of 140.23 g/mol, XLogP of 0.85, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5-trimethyl-2,4-dihydro-1H-pyridin-4-amine is sourced from PubChem (CID 146427332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).