pyridine;1-pyridin-2-ylethanamine

C12H15N3 — CID 159737903

IUPACpyridine;1-pyridin-2-ylethanamine
SMILESCC(N)c1ccccn1.c1ccncc1
InChIInChI=1S/C7H10N2.C5H5N/c1-6(8)7-4-2-3-5-9-7;1-2-4-6-5-3-1/h2-6H,8H2,1H3;1-5H
InChIKeyNCBLTXQCAWZXAV-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.18
Rot. Bonds1

About pyridine;1-pyridin-2-ylethanamine

pyridine;1-pyridin-2-ylethanamine (PubChem CID 159737903) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is pyridine;1-pyridin-2-ylethanamine.

Molecular Properties

Compound Namepyridine;1-pyridin-2-ylethanamine
PubChem CID159737903
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Namepyridine;1-pyridin-2-ylethanamine
SMILESCC(N)c1ccccn1.c1ccncc1
InChIInChI=1S/C7H10N2.C5H5N/c1-6(8)7-4-2-3-5-9-7;1-2-4-6-5-3-1/h2-6H,8H2,1H3;1-5H
InChIKeyNCBLTXQCAWZXAV-UHFFFAOYSA-N
XLogP2.18
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methylmethanamine;1-pyridin-2-ylethanamine
CID 143812006
oxalic acid;1-pyridin-2-ylethanamine
CID 45156268
(3R)-3-pyridin-2-ylbutan-2-amine
CID 140704268
(1R,2S)-1-pyridin-2-ylpropane-1,2-diamine
CID 131142947
(1R)-2-methyl-1-pyridin-2-ylpropan-1-amine;dihydrochloride
CID 86767543
(1S)-1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)ethanamine
CID 81405517
2-[(2R)-3-methylbutan-2-yl]pyridine
CID 26793118
ethane;2-methylpropane;2-propan-2-ylpyridine
CID 160963174
chloro(pyridin-2-yl)methanamine
CID 22075524
2-pyridin-2-ylpropan-1-amine
CID 21481533
ethane;2-(1-phenylethyl)pyridine
CID 143899083
2,4-dipyridin-2-ylpentan-3-one
CID 141048798

Frequently Asked Questions

What is the IUPAC name of pyridine;1-pyridin-2-ylethanamine?
The IUPAC name of pyridine;1-pyridin-2-ylethanamine (CID 159737903) is pyridine;1-pyridin-2-ylethanamine.
What is the SMILES notation for pyridine;1-pyridin-2-ylethanamine?
The canonical SMILES for pyridine;1-pyridin-2-ylethanamine is CC(N)c1ccccn1.c1ccncc1.
What is the InChIKey of pyridine;1-pyridin-2-ylethanamine?
The InChIKey is NCBLTXQCAWZXAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2.C5H5N/c1-6(8)7-4-2-3-5-9-7;1-2-4-6-5-3-1/h2-6H,8H2,1H3;1-5H.
What are the key properties of pyridine;1-pyridin-2-ylethanamine?
pyridine;1-pyridin-2-ylethanamine has a molecular weight of 201.27 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine;1-pyridin-2-ylethanamine is sourced from PubChem (CID 159737903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).