N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine

C13H20N4 — CID 43137193

IUPACN'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine
SMILESCCN(CCCN)Cc1cn2ccccc2n1
InChIInChI=1S/C13H20N4/c1-2-16(8-5-7-14)10-12-11-17-9-4-3-6-13(17)15-12/h3-4,6,9,11H,2,5,7-8,10,14H2,1H3
InChIKeyYTIRRQJRVBOFDW-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.50
Rot. Bonds6

About N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine

N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine (PubChem CID 43137193) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine
PubChem CID43137193
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC NameN'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine
SMILESCCN(CCCN)Cc1cn2ccccc2n1
InChIInChI=1S/C13H20N4/c1-2-16(8-5-7-14)10-12-11-17-9-4-3-6-13(17)15-12/h3-4,6,9,11H,2,5,7-8,10,14H2,1H3
InChIKeyYTIRRQJRVBOFDW-UHFFFAOYSA-N
XLogP1.50
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920
2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 63387084
2-[ethyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 54900006
2-N-ethyl-2-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropane-1,2-diamine
CID 62010368
2-imidazo[1,2-a]pyridin-2-ylethanamine
CID 7536516
[2-[[imidazo[1,2-a]pyridin-2-ylmethyl(methyl)amino]methyl]phenyl]methanamine
CID 60922596
2-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-N,2-dimethylbutane-1,2-diamine
CID 62009772
N'-ethyl-N'-[(1-methylpyrazol-3-yl)methyl]propane-1,3-diamine
CID 82865963
2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 107425654
[3-[[imidazo[1,2-a]pyridin-2-ylmethyl(methyl)amino]methyl]phenyl]methanamine
CID 43248734
3-(aminomethyl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylaniline
CID 62970661
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-(pyrrolidin-2-ylmethyl)butan-1-amine
CID 106604987

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine?
The IUPAC name of N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine (CID 43137193) is N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine.
What is the SMILES notation for N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine?
The canonical SMILES for N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine is CCN(CCCN)Cc1cn2ccccc2n1.
What is the InChIKey of N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine?
The InChIKey is YTIRRQJRVBOFDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-2-16(8-5-7-14)10-12-11-17-9-4-3-6-13(17)15-12/h3-4,6,9,11H,2,5,7-8,10,14H2,1H3.
What are the key properties of N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine?
N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine has a molecular weight of 232.33 g/mol, XLogP of 1.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine is sourced from PubChem (CID 43137193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).