6-methyl-2,5-dihydro-1H-pyridin-6-amine

C6H12N2 — CID 138527537

IUPAC6-methyl-2,5-dihydro-1H-pyridin-6-amine
SMILESCC1(N)CC=CCN1
InChIInChI=1S/C6H12N2/c1-6(7)4-2-3-5-8-6/h2-3,8H,4-5,7H2,1H3
InChIKeyMYYBOKRSVIEWBH-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.21
Rot. Bonds

About 6-methyl-2,5-dihydro-1H-pyridin-6-amine

6-methyl-2,5-dihydro-1H-pyridin-6-amine (PubChem CID 138527537) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 6-methyl-2,5-dihydro-1H-pyridin-6-amine.

Molecular Properties

Compound Name6-methyl-2,5-dihydro-1H-pyridin-6-amine
PubChem CID138527537
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name6-methyl-2,5-dihydro-1H-pyridin-6-amine
SMILESCC1(N)CC=CCN1
InChIInChI=1S/C6H12N2/c1-6(7)4-2-3-5-8-6/h2-3,8H,4-5,7H2,1H3
InChIKeyMYYBOKRSVIEWBH-UHFFFAOYSA-N
XLogP0.21
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.21
H-Bond Donors ≤ 52
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 6-methyl-2,5-dihydro-1H-pyridin-6-amine?
The IUPAC name of 6-methyl-2,5-dihydro-1H-pyridin-6-amine (CID 138527537) is 6-methyl-2,5-dihydro-1H-pyridin-6-amine.
What is the SMILES notation for 6-methyl-2,5-dihydro-1H-pyridin-6-amine?
The canonical SMILES for 6-methyl-2,5-dihydro-1H-pyridin-6-amine is CC1(N)CC=CCN1.
What is the InChIKey of 6-methyl-2,5-dihydro-1H-pyridin-6-amine?
The InChIKey is MYYBOKRSVIEWBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-6(7)4-2-3-5-8-6/h2-3,8H,4-5,7H2,1H3.
What are the key properties of 6-methyl-2,5-dihydro-1H-pyridin-6-amine?
6-methyl-2,5-dihydro-1H-pyridin-6-amine has a molecular weight of 112.18 g/mol, XLogP of 0.21, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,5-dihydro-1H-pyridin-6-amine is sourced from PubChem (CID 138527537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).