2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine

C14H20N4 — CID 64833998

IUPAC2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
SMILESCCC1CN(Cc2cn3ccccc3n2)CCN1
InChIInChI=1S/C14H20N4/c1-2-12-9-17(8-6-15-12)10-13-11-18-7-4-3-5-14(18)16-13/h3-5,7,11-12,15H,2,6,8-10H2,1H3
InChIKeyLDJLDJMELMKLLJ-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.52
Rot. Bonds3

About 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine

2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine (PubChem CID 64833998) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
PubChem CID64833998
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
SMILESCCC1CN(Cc2cn3ccccc3n2)CCN1
InChIInChI=1S/C14H20N4/c1-2-12-9-17(8-6-15-12)10-13-11-18-7-4-3-5-14(18)16-13/h3-5,7,11-12,15H,2,6,8-10H2,1H3
InChIKeyLDJLDJMELMKLLJ-UHFFFAOYSA-N
XLogP1.52
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64831720
2-[(3-methyl-1,4-diazepan-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64859024
2-[(5-ethyl-2-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64841330
1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-3-ol
CID 62918360
2-[(3-ethyl-3-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64834447
2-[(3-bromopyrrolidin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 80677191
(NE)-N-[3-ethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidin-4-ylidene]hydroxylamine
CID 114509483
(3R)-1-benzyl-3-ethylpiperazine
CID 45356982
(3S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidin-3-amine
CID 129366305
2-[[(3S)-3-(methoxymethyl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 94920556
[1-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methylpiperidin-3-yl]methanamine
CID 114959821
2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 45366493

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine (CID 64833998) is 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine is CCC1CN(Cc2cn3ccccc3n2)CCN1.
What is the InChIKey of 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The InChIKey is LDJLDJMELMKLLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-2-12-9-17(8-6-15-12)10-13-11-18-7-4-3-5-14(18)16-13/h3-5,7,11-12,15H,2,6,8-10H2,1H3.
What are the key properties of 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine has a molecular weight of 244.34 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 64833998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).