N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine

C20H17ClN4O — CID 25205191

IUPACN-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(-c2cnc3c(NCc4cccc(Cl)c4)nccn23)cc1
InChIInChI=1S/C20H17ClN4O/c1-26-17-7-5-15(6-8-17)18-13-24-20-19(22-9-10-25(18)20)23-12-14-3-2-4-16(21)11-14/h2-11,13H,12H2,1H3,(H,22,23)
InChIKeyDPEFCYMNJVUYQS-UHFFFAOYSA-N
MW364.84 g/mol
LogP4.67
Rot. Bonds5

About N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine

N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 25205191) has the molecular formula C20H17ClN4O and a molecular weight of 364.84 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID25205191
Molecular FormulaC20H17ClN4O
Molecular Weight364.84 g/mol
Exact Mass364.11
IUPAC NameN-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(-c2cnc3c(NCc4cccc(Cl)c4)nccn23)cc1
InChIInChI=1S/C20H17ClN4O/c1-26-17-7-5-15(6-8-17)18-13-24-20-19(22-9-10-25(18)20)23-12-14-3-2-4-16(21)11-14/h2-11,13H,12H2,1H3,(H,22,23)
InChIKeyDPEFCYMNJVUYQS-UHFFFAOYSA-N
XLogP4.67
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.84
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-(2-Butyl-1-(4-(4-chlorophenoxy)phenyl)-1H-imidazol-4-yl)phenoxy)-N,N-diethyl-1-propanamine
CID 11180124
Cambritaxestat
CID 122199235
7-Methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 146659124
7-butyl-6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 3641059
2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine
CID 694963
2-(4-Ethoxyphenyl)imidazo[1,2-a]pyridine
CID 720519
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
3-(6-Methoxypyridin-2-yl)-7-phenylimidazo[1,2-a]pyridine
CID 5329342
6-(4-methoxyphenyl)-7-propyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538784
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 34
CID 6538787
(4-[3-[4-(2-Methoxyphenyl)piperazin-1-yl]butoxy]phenyl)imidazo[1,2-a]pyridine
CID 10479214
N-Butyl-2-(6,8-dichloro-2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl)-N-methylacetamide
CID 24945827

Frequently Asked Questions

What is the IUPAC name of N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine (CID 25205191) is N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine is COc1ccc(-c2cnc3c(NCc4cccc(Cl)c4)nccn23)cc1.
What is the InChIKey of N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is DPEFCYMNJVUYQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O/c1-26-17-7-5-15(6-8-17)18-13-24-20-19(22-9-10-25(18)20)23-12-14-3-2-4-16(21)11-14/h2-11,13H,12H2,1H3,(H,22,23).
What are the key properties of N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 364.84 g/mol, XLogP of 4.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 25205191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).