2-pyridin-2-yl-1-pyridin-3-ylethanamine

C12H13N3 — CID 43138968

IUPAC2-pyridin-2-yl-1-pyridin-3-ylethanamine
SMILESNC(Cc1ccccn1)c1cccnc1
InChIInChI=1S/C12H13N3/c13-12(10-4-3-6-14-9-10)8-11-5-1-2-7-15-11/h1-7,9,12H,8,13H2
InChIKeyUBMCONSRKGUOFH-UHFFFAOYSA-N
MW199.26 g/mol
LogP1.72
Rot. Bonds3

About 2-pyridin-2-yl-1-pyridin-3-ylethanamine

2-pyridin-2-yl-1-pyridin-3-ylethanamine (PubChem CID 43138968) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 2-pyridin-2-yl-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-pyridin-2-yl-1-pyridin-3-ylethanamine
PubChem CID43138968
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name2-pyridin-2-yl-1-pyridin-3-ylethanamine
SMILESNC(Cc1ccccn1)c1cccnc1
InChIInChI=1S/C12H13N3/c13-12(10-4-3-6-14-9-10)8-11-5-1-2-7-15-11/h1-7,9,12H,8,13H2
InChIKeyUBMCONSRKGUOFH-UHFFFAOYSA-N
XLogP1.72
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-1-pyridin-3-ylethanamine?
The IUPAC name of 2-pyridin-2-yl-1-pyridin-3-ylethanamine (CID 43138968) is 2-pyridin-2-yl-1-pyridin-3-ylethanamine.
What is the SMILES notation for 2-pyridin-2-yl-1-pyridin-3-ylethanamine?
The canonical SMILES for 2-pyridin-2-yl-1-pyridin-3-ylethanamine is NC(Cc1ccccn1)c1cccnc1.
What is the InChIKey of 2-pyridin-2-yl-1-pyridin-3-ylethanamine?
The InChIKey is UBMCONSRKGUOFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c13-12(10-4-3-6-14-9-10)8-11-5-1-2-7-15-11/h1-7,9,12H,8,13H2.
What are the key properties of 2-pyridin-2-yl-1-pyridin-3-ylethanamine?
2-pyridin-2-yl-1-pyridin-3-ylethanamine has a molecular weight of 199.26 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-1-pyridin-3-ylethanamine is sourced from PubChem (CID 43138968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).