N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine

C21H27N5 — CID 171913926

IUPACN-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine
SMILESCN(CCN1CCN(c2ccccc2)CC1)Cc1cnc2ccccn12
InChIInChI=1S/C21H27N5/c1-23(18-20-17-22-21-9-5-6-10-26(20)21)11-12-24-13-15-25(16-14-24)19-7-3-2-4-8-19/h2-10,17H,11-16,18H2,1H3
InChIKeyRAIZBCZDYGRBLO-UHFFFAOYSA-N
MW349.48 g/mol
LogP2.59
Rot. Bonds6

About N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine

N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine (PubChem CID 171913926) has the molecular formula C21H27N5 and a molecular weight of 349.48 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine
PubChem CID171913926
Molecular FormulaC21H27N5
Molecular Weight349.48 g/mol
Exact Mass349.23
IUPAC NameN-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine
SMILESCN(CCN1CCN(c2ccccc2)CC1)Cc1cnc2ccccn12
InChIInChI=1S/C21H27N5/c1-23(18-20-17-22-21-9-5-6-10-26(20)21)11-12-24-13-15-25(16-14-24)19-7-3-2-4-8-19/h2-10,17H,11-16,18H2,1H3
InChIKeyRAIZBCZDYGRBLO-UHFFFAOYSA-N
XLogP2.59
TPSA27.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-ethylpiperazin-1-yl)-N-(imidazo[1,2-a]pyridin-3-ylmethyl)aniline
CID 99834709
N,5-dimethyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]pyrimidin-2-amine
CID 133418164
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine
CID 74246051
1-cyclohex-3-en-1-yl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylmethanamine
CID 74247420
4-(imidazo[1,2-a]pyridin-3-ylmethyl)-N,N-dimethylpiperazine-1-sulfonamide
CID 90571984
1-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]ethanone
CID 90571718
N-(2-chlorophenyl)-3-[imidazo[1,2-a]pyridin-3-ylmethyl(methyl)amino]propanamide
CID 91829710
N-methyl-N-[2-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]ethyl]aniline
CID 84587099
N-(3,5-difluorophenyl)-2-[imidazo[1,2-a]pyridin-3-ylmethyl(methyl)amino]acetamide
CID 71873708
3-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 11278841
3-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 11324351
2-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]phenol
CID 71929727

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine?
The IUPAC name of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine (CID 171913926) is N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine is CN(CCN1CCN(c2ccccc2)CC1)Cc1cnc2ccccn12.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine?
The InChIKey is RAIZBCZDYGRBLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N5/c1-23(18-20-17-22-21-9-5-6-10-26(20)21)11-12-24-13-15-25(16-14-24)19-7-3-2-4-8-19/h2-10,17H,11-16,18H2,1H3.
What are the key properties of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine?
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine has a molecular weight of 349.48 g/mol, XLogP of 2.59, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-2-(4-phenylpiperazin-1-yl)ethanamine is sourced from PubChem (CID 171913926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).