ethane;6-(4-methylphenyl)pyridin-3-amine

C16H24N2 — CID 145467469

IUPACethane;6-(4-methylphenyl)pyridin-3-amine
SMILESCC.CC.Cc1ccc(-c2ccc(N)cn2)cc1
InChIInChI=1S/C12H12N2.2C2H6/c1-9-2-4-10(5-3-9)12-7-6-11(13)8-14-12;2*1-2/h2-8H,13H2,1H3;2*1-2H3
InChIKeyVVMOCVHFSHESMM-UHFFFAOYSA-N
MW244.38 g/mol
LogP4.69
Rot. Bonds1

About ethane;6-(4-methylphenyl)pyridin-3-amine

ethane;6-(4-methylphenyl)pyridin-3-amine (PubChem CID 145467469) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is ethane;6-(4-methylphenyl)pyridin-3-amine.

Molecular Properties

Compound Nameethane;6-(4-methylphenyl)pyridin-3-amine
PubChem CID145467469
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Nameethane;6-(4-methylphenyl)pyridin-3-amine
SMILESCC.CC.Cc1ccc(-c2ccc(N)cn2)cc1
InChIInChI=1S/C12H12N2.2C2H6/c1-9-2-4-10(5-3-9)12-7-6-11(13)8-14-12;2*1-2/h2-8H,13H2,1H3;2*1-2H3
InChIKeyVVMOCVHFSHESMM-UHFFFAOYSA-N
XLogP4.69
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;6-(4-methylphenyl)pyridin-3-amine?
The IUPAC name of ethane;6-(4-methylphenyl)pyridin-3-amine (CID 145467469) is ethane;6-(4-methylphenyl)pyridin-3-amine.
What is the SMILES notation for ethane;6-(4-methylphenyl)pyridin-3-amine?
The canonical SMILES for ethane;6-(4-methylphenyl)pyridin-3-amine is CC.CC.Cc1ccc(-c2ccc(N)cn2)cc1.
What is the InChIKey of ethane;6-(4-methylphenyl)pyridin-3-amine?
The InChIKey is VVMOCVHFSHESMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2.2C2H6/c1-9-2-4-10(5-3-9)12-7-6-11(13)8-14-12;2*1-2/h2-8H,13H2,1H3;2*1-2H3.
What are the key properties of ethane;6-(4-methylphenyl)pyridin-3-amine?
ethane;6-(4-methylphenyl)pyridin-3-amine has a molecular weight of 244.38 g/mol, XLogP of 4.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-(4-methylphenyl)pyridin-3-amine is sourced from PubChem (CID 145467469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).