1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione

C15H18N4O2 — CID 64878983

IUPAC1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)C1NC(=O)CN(Cc2cn3ccccc3n2)C1=O
InChIInChI=1S/C15H18N4O2/c1-10(2)14-15(21)19(9-13(20)17-14)8-11-7-18-6-4-3-5-12(18)16-11/h3-7,10,14H,8-9H2,1-2H3,(H,17,20)
InChIKeyFZQJGXHFBRQKRC-UHFFFAOYSA-N
MW286.33 g/mol
LogP0.82
Rot. Bonds3

About 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione

1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione (PubChem CID 64878983) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione
PubChem CID64878983
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)C1NC(=O)CN(Cc2cn3ccccc3n2)C1=O
InChIInChI=1S/C15H18N4O2/c1-10(2)14-15(21)19(9-13(20)17-14)8-11-7-18-6-4-3-5-12(18)16-11/h3-7,10,14H,8-9H2,1-2H3,(H,17,20)
InChIKeyFZQJGXHFBRQKRC-UHFFFAOYSA-N
XLogP0.82
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3,3-dimethylpiperazine-2,5-dione
CID 64879027
1-[(2-bromophenyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 64881106
2-[(7-methyl-3-propan-2-yl-1,4-diazepan-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64870552
4-(aminomethyl)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-one
CID 168660388
2-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 7039929
8-tert-butyl-3-(imidazo[1,2-a]pyridin-2-ylmethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 17391732
2-[(2,6-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridine bromide
CID 53347072
2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 45366493
1-[(3-methyl-4-pyridinyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 114702104
(3S)-1-[(3-fluorophenyl)methyl]-4-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylpiperazine-2,5-dione
CID 165428167
3-imidazo[1,2-a]pyridin-2-yl-2-methylpropan-1-amine
CID 83877207
(3S)-3-benzyl-4-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methylpiperazine-2,5-dione
CID 165419607

Frequently Asked Questions

What is the IUPAC name of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione (CID 64878983) is 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione is CC(C)C1NC(=O)CN(Cc2cn3ccccc3n2)C1=O.
What is the InChIKey of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione?
The InChIKey is FZQJGXHFBRQKRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-10(2)14-15(21)19(9-13(20)17-14)8-11-7-18-6-4-3-5-12(18)16-11/h3-7,10,14H,8-9H2,1-2H3,(H,17,20).
What are the key properties of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione?
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione has a molecular weight of 286.33 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64878983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).