ethane;N-methylpyridin-3-amine

C8H14N2 — CID 91430147

IUPACethane;N-methylpyridin-3-amine
SMILESCC.CNc1cccnc1
InChIInChI=1S/C6H8N2.C2H6/c1-7-6-3-2-4-8-5-6;1-2/h2-5,7H,1H3;1-2H3
InChIKeyVYACEKUXKSSXAF-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.15
Rot. Bonds1

About ethane;N-methylpyridin-3-amine

ethane;N-methylpyridin-3-amine (PubChem CID 91430147) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is ethane;N-methylpyridin-3-amine.

Molecular Properties

Compound Nameethane;N-methylpyridin-3-amine
PubChem CID91430147
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Nameethane;N-methylpyridin-3-amine
SMILESCC.CNc1cccnc1
InChIInChI=1S/C6H8N2.C2H6/c1-7-6-3-2-4-8-5-6;1-2/h2-5,7H,1H3;1-2H3
InChIKeyVYACEKUXKSSXAF-UHFFFAOYSA-N
XLogP2.15
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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benzene-1,3-dicarboxylic acid;N-methylpyridin-3-amine;hydrochloride
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N-methylsulfanylpyridin-3-amine
CID 126541026
N-(3-methylbut-2-en-2-yl)pyridin-3-amine
CID 58929048
N-methyl-4-(2-pyridin-3-ylethynyl)aniline
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Frequently Asked Questions

What is the IUPAC name of ethane;N-methylpyridin-3-amine?
The IUPAC name of ethane;N-methylpyridin-3-amine (CID 91430147) is ethane;N-methylpyridin-3-amine.
What is the SMILES notation for ethane;N-methylpyridin-3-amine?
The canonical SMILES for ethane;N-methylpyridin-3-amine is CC.CNc1cccnc1.
What is the InChIKey of ethane;N-methylpyridin-3-amine?
The InChIKey is VYACEKUXKSSXAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2.C2H6/c1-7-6-3-2-4-8-5-6;1-2/h2-5,7H,1H3;1-2H3.
What are the key properties of ethane;N-methylpyridin-3-amine?
ethane;N-methylpyridin-3-amine has a molecular weight of 138.21 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methylpyridin-3-amine is sourced from PubChem (CID 91430147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).