2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine

C20H25N5O — CID 172903088

IUPAC2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESCOc1cccc(CN2CCN(Cc3cn4ccccc4n3)CC2C)n1
InChIInChI=1S/C20H25N5O/c1-16-12-23(13-18-15-25-9-4-3-7-19(25)21-18)10-11-24(16)14-17-6-5-8-20(22-17)26-2/h3-9,15-16H,10-14H2,1-2H3
InChIKeyQLMFMWSUNDAYAP-UHFFFAOYSA-N
MW351.45 g/mol
LogP2.44
Rot. Bonds5

About 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine

2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine (PubChem CID 172903088) has the molecular formula C20H25N5O and a molecular weight of 351.45 g/mol. Its IUPAC name is 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine
PubChem CID172903088
Molecular FormulaC20H25N5O
Molecular Weight351.45 g/mol
Exact Mass351.21
IUPAC Name2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESCOc1cccc(CN2CCN(Cc3cn4ccccc4n3)CC2C)n1
InChIInChI=1S/C20H25N5O/c1-16-12-23(13-18-15-25-9-4-3-7-19(25)21-18)10-11-24(16)14-17-6-5-8-20(22-17)26-2/h3-9,15-16H,10-14H2,1-2H3
InChIKeyQLMFMWSUNDAYAP-UHFFFAOYSA-N
XLogP2.44
TPSA45.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine with MolForge

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Related Compounds

5-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]-3-methyl-1,2,4-oxadiazole
CID 172900745
2-[[(3S)-3-(methoxymethyl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 94920556
2-[(3-methyl-1,4-diazepan-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64859024
1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-3-ol
CID 62918360
2-[(3-bromopyrrolidin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 80677191
(3R)-1-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazine
CID 104975727
1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholin-2-yl]ethanamine
CID 115314933
2-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]quinoxaline
CID 172892521
[1-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methylpiperidin-3-yl]methanamine
CID 114959821
1-[(6-methoxy-2-pyridinyl)methyl]-4-methylpiperidin-3-ol
CID 103897931
1-benzyl-4-[(6-methoxy-2-pyridinyl)methyl]piperazine
CID 172891684
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-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine (CID 172903088) is 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine is COc1cccc(CN2CCN(Cc3cn4ccccc4n3)CC2C)n1.
What is the InChIKey of 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The InChIKey is QLMFMWSUNDAYAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O/c1-16-12-23(13-18-15-25-9-4-3-7-19(25)21-18)10-11-24(16)14-17-6-5-8-20(22-17)26-2/h3-9,15-16H,10-14H2,1-2H3.
What are the key properties of 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine has a molecular weight of 351.45 g/mol, XLogP of 2.44, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 172903088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).