3-propylpyridin-2-amine

C8H12N2 — CID 13344045

IUPAC3-propylpyridin-2-amine
SMILESCCCc1cccnc1N
InChIInChI=1S/C8H12N2/c1-2-4-7-5-3-6-10-8(7)9/h3,5-6H,2,4H2,1H3,(H2,9,10)
InChIKeyFJIRTSVMONBPNB-UHFFFAOYSA-N
MW136.20 g/mol
LogP1.62
Rot. Bonds2

About 3-propylpyridin-2-amine

3-propylpyridin-2-amine (PubChem CID 13344045) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 3-propylpyridin-2-amine.

Molecular Properties

Compound Name3-propylpyridin-2-amine
PubChem CID13344045
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name3-propylpyridin-2-amine
SMILESCCCc1cccnc1N
InChIInChI=1S/C8H12N2/c1-2-4-7-5-3-6-10-8(7)9/h3,5-6H,2,4H2,1H3,(H2,9,10)
InChIKeyFJIRTSVMONBPNB-UHFFFAOYSA-N
XLogP1.62
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-propylpyridin-2-amine?
The IUPAC name of 3-propylpyridin-2-amine (CID 13344045) is 3-propylpyridin-2-amine.
What is the SMILES notation for 3-propylpyridin-2-amine?
The canonical SMILES for 3-propylpyridin-2-amine is CCCc1cccnc1N.
What is the InChIKey of 3-propylpyridin-2-amine?
The InChIKey is FJIRTSVMONBPNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-2-4-7-5-3-6-10-8(7)9/h3,5-6H,2,4H2,1H3,(H2,9,10).
What are the key properties of 3-propylpyridin-2-amine?
3-propylpyridin-2-amine has a molecular weight of 136.20 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propylpyridin-2-amine is sourced from PubChem (CID 13344045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).