ethane;3-propylpyridin-2-amine

C10H18N2 — CID 176926436

IUPACethane;3-propylpyridin-2-amine
SMILESCC.CCCc1cccnc1N
InChIInChI=1S/C8H12N2.C2H6/c1-2-4-7-5-3-6-10-8(7)9;1-2/h3,5-6H,2,4H2,1H3,(H2,9,10);1-2H3
InChIKeyYIWNZHRNESRSGM-UHFFFAOYSA-N
MW166.27 g/mol
LogP2.64
Rot. Bonds2

About ethane;3-propylpyridin-2-amine

ethane;3-propylpyridin-2-amine (PubChem CID 176926436) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is ethane;3-propylpyridin-2-amine.

Molecular Properties

Compound Nameethane;3-propylpyridin-2-amine
PubChem CID176926436
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Nameethane;3-propylpyridin-2-amine
SMILESCC.CCCc1cccnc1N
InChIInChI=1S/C8H12N2.C2H6/c1-2-4-7-5-3-6-10-8(7)9;1-2/h3,5-6H,2,4H2,1H3,(H2,9,10);1-2H3
InChIKeyYIWNZHRNESRSGM-UHFFFAOYSA-N
XLogP2.64
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;3-propylpyridin-2-amine?
The IUPAC name of ethane;3-propylpyridin-2-amine (CID 176926436) is ethane;3-propylpyridin-2-amine.
What is the SMILES notation for ethane;3-propylpyridin-2-amine?
The canonical SMILES for ethane;3-propylpyridin-2-amine is CC.CCCc1cccnc1N.
What is the InChIKey of ethane;3-propylpyridin-2-amine?
The InChIKey is YIWNZHRNESRSGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2.C2H6/c1-2-4-7-5-3-6-10-8(7)9;1-2/h3,5-6H,2,4H2,1H3,(H2,9,10);1-2H3.
What are the key properties of ethane;3-propylpyridin-2-amine?
ethane;3-propylpyridin-2-amine has a molecular weight of 166.27 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-propylpyridin-2-amine is sourced from PubChem (CID 176926436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).