N-methyl-2,2-dipyridin-4-ylethanamine

C13H15N3 — CID 116824958

IUPACN-methyl-2,2-dipyridin-4-ylethanamine
SMILESCNCC(c1ccncc1)c1ccncc1
InChIInChI=1S/C13H15N3/c1-14-10-13(11-2-6-15-7-3-11)12-4-8-16-9-5-12/h2-9,13-14H,10H2,1H3
InChIKeyLVTJWSRGQSKPSQ-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.83
Rot. Bonds4

About N-methyl-2,2-dipyridin-4-ylethanamine

N-methyl-2,2-dipyridin-4-ylethanamine (PubChem CID 116824958) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-methyl-2,2-dipyridin-4-ylethanamine.

Molecular Properties

Compound NameN-methyl-2,2-dipyridin-4-ylethanamine
PubChem CID116824958
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC NameN-methyl-2,2-dipyridin-4-ylethanamine
SMILESCNCC(c1ccncc1)c1ccncc1
InChIInChI=1S/C13H15N3/c1-14-10-13(11-2-6-15-7-3-11)12-4-8-16-9-5-12/h2-9,13-14H,10H2,1H3
InChIKeyLVTJWSRGQSKPSQ-UHFFFAOYSA-N
XLogP1.83
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2,2-dipyridin-4-ylethanamine?
The IUPAC name of N-methyl-2,2-dipyridin-4-ylethanamine (CID 116824958) is N-methyl-2,2-dipyridin-4-ylethanamine.
What is the SMILES notation for N-methyl-2,2-dipyridin-4-ylethanamine?
The canonical SMILES for N-methyl-2,2-dipyridin-4-ylethanamine is CNCC(c1ccncc1)c1ccncc1.
What is the InChIKey of N-methyl-2,2-dipyridin-4-ylethanamine?
The InChIKey is LVTJWSRGQSKPSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-14-10-13(11-2-6-15-7-3-11)12-4-8-16-9-5-12/h2-9,13-14H,10H2,1H3.
What are the key properties of N-methyl-2,2-dipyridin-4-ylethanamine?
N-methyl-2,2-dipyridin-4-ylethanamine has a molecular weight of 213.28 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2,2-dipyridin-4-ylethanamine is sourced from PubChem (CID 116824958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).