1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine

C21H24N4 — CID 15806675

IUPAC1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine
SMILESCC(c1ccccn1)N(C(C)c1ccccn1)C(C)c1ccccn1
InChIInChI=1S/C21H24N4/c1-16(19-10-4-7-13-22-19)25(17(2)20-11-5-8-14-23-20)18(3)21-12-6-9-15-24-21/h4-18H,1-3H3
InChIKeyZGHQNHWQQXRSDD-UHFFFAOYSA-N
MW332.45 g/mol
LogP4.76
Rot. Bonds6

About 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine

1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine (PubChem CID 15806675) has the molecular formula C21H24N4 and a molecular weight of 332.45 g/mol. Its IUPAC name is 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine.

Molecular Properties

Compound Name1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine
PubChem CID15806675
Molecular FormulaC21H24N4
Molecular Weight332.45 g/mol
Exact Mass332.20
IUPAC Name1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine
SMILESCC(c1ccccn1)N(C(C)c1ccccn1)C(C)c1ccccn1
InChIInChI=1S/C21H24N4/c1-16(19-10-4-7-13-22-19)25(17(2)20-11-5-8-14-23-20)18(3)21-12-6-9-15-24-21/h4-18H,1-3H3
InChIKeyZGHQNHWQQXRSDD-UHFFFAOYSA-N
XLogP4.76
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2R)-3-methylbutan-2-yl]pyridine
CID 26793118
ethane;2-methylpropane;2-propan-2-ylpyridine
CID 160963174
N-methyl-N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine
CID 86329926
N,2-dimethyl-N-(1-pyridin-2-ylethyl)propanamide
CID 163258537
N,N'-bis[(1S)-1-pyridin-2-ylethyl]-N,N'-bis(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 101339503
2-[(1R)-1-[(1R)-1-pyridin-2-ylethyl]sulfanylethyl]pyridine
CID 15893453
(1S)-1-pyridin-2-ylethanol;hydrochloride
CID 71757448
2-(3,3,4,4-tetramethylpentan-2-yl)pyridine
CID 146411228
2-(dipyridin-2-ylmethyl)pyridine
CID 10332212
(2R)-2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]propanamide
CID 124590926
2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid
CID 95935067
N',N'-bis(1-pyridin-2-ylethyl)butane-1,4-diamine
CID 58997062

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine?
The IUPAC name of 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine (CID 15806675) is 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine.
What is the SMILES notation for 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine?
The canonical SMILES for 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine is CC(c1ccccn1)N(C(C)c1ccccn1)C(C)c1ccccn1.
What is the InChIKey of 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine?
The InChIKey is ZGHQNHWQQXRSDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4/c1-16(19-10-4-7-13-22-19)25(17(2)20-11-5-8-14-23-20)18(3)21-12-6-9-15-24-21/h4-18H,1-3H3.
What are the key properties of 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine?
1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine has a molecular weight of 332.45 g/mol, XLogP of 4.76, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine is sourced from PubChem (CID 15806675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).