2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine

C21H27N5O — CID 131671374

IUPAC2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine
SMILESCN1CCN(Cc2ccco2)CC1c1cn2c(N3CCCC3)cccc2n1
InChIInChI=1S/C21H27N5O/c1-23-11-12-24(14-17-6-5-13-27-17)16-19(23)18-15-26-20(22-18)7-4-8-21(26)25-9-2-3-10-25/h4-8,13,15,19H,2-3,9-12,14,16H2,1H3
InChIKeyFHPKKXNIJIJTQQ-UHFFFAOYSA-N
MW365.48 g/mol
LogP3.02
Rot. Bonds4

About 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine

2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine (PubChem CID 131671374) has the molecular formula C21H27N5O and a molecular weight of 365.48 g/mol. Its IUPAC name is 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine
PubChem CID131671374
Molecular FormulaC21H27N5O
Molecular Weight365.48 g/mol
Exact Mass365.22
IUPAC Name2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine
SMILESCN1CCN(Cc2ccco2)CC1c1cn2c(N3CCCC3)cccc2n1
InChIInChI=1S/C21H27N5O/c1-23-11-12-24(14-17-6-5-13-27-17)16-19(23)18-15-26-20(22-18)7-4-8-21(26)25-9-2-3-10-25/h4-8,13,15,19H,2-3,9-12,14,16H2,1H3
InChIKeyFHPKKXNIJIJTQQ-UHFFFAOYSA-N
XLogP3.02
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine with MolForge

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Related Compounds

2-[[4-methyl-3-(5-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)piperazin-1-yl]methyl]-1,3-thiazole;tris(2,2,2-trifluoroacetic acid)
CID 155831221
2-(furan-2-yl)-1-[2-(5-morpholin-4-ylimidazo[1,2-a]pyridin-2-yl)morpholin-4-yl]ethanone
CID 131673396
4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine
CID 131668896
1-(furan-2-ylmethyl)-3-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine
CID 53192047
3-ethyl-1-(furan-2-ylmethyl)pyrrolidine
CID 130727430
1-(furan-2-ylmethyl)piperidine;methanamine
CID 162741090
1-(furan-2-ylmethyl)-4-methylpiperazine;methanamine
CID 162740974
6-[1-(furan-2-ylmethyl)piperidin-4-yl]-1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridine
CID 97415326
2-[1-methyl-4-[(3-methylphenyl)methyl]piperazin-2-yl]-5-pyridin-4-ylimidazo[1,2-a]pyridine;tris(2,2,2-trifluoroacetic acid)
CID 155831070
(3R,4S)-1-(furan-2-ylmethyl)pyrrolidine-3,4-diol
CID 79420188
1-(furan-2-ylmethyl)pyrrolidine-3,4-diol
CID 106671878
4-[2-[1-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)piperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine;tetrakis(2,2,2-trifluoroacetic acid)
CID 155831488

Frequently Asked Questions

What is the IUPAC name of 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine?
The IUPAC name of 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine (CID 131671374) is 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine is CN1CCN(Cc2ccco2)CC1c1cn2c(N3CCCC3)cccc2n1.
What is the InChIKey of 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine?
The InChIKey is FHPKKXNIJIJTQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N5O/c1-23-11-12-24(14-17-6-5-13-27-17)16-19(23)18-15-26-20(22-18)7-4-8-21(26)25-9-2-3-10-25/h4-8,13,15,19H,2-3,9-12,14,16H2,1H3.
What are the key properties of 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine?
2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine has a molecular weight of 365.48 g/mol, XLogP of 3.02, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(furan-2-ylmethyl)-1-methylpiperazin-2-yl]-5-pyrrolidin-1-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 131671374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).