3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine

C20H24N6O — CID 143464743

IUPAC3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESC=C(/C=N\N(C)C)c1cnc2c(Nc3cccc(OC(C)C)c3)nccn12
InChIInChI=1S/C20H24N6O/c1-14(2)27-17-8-6-7-16(11-17)24-19-20-22-13-18(26(20)10-9-21-19)15(3)12-23-25(4)5/h6-14H,3H2,1-2,4-5H3,(H,21,24)/b23-12-
InChIKeyYHZMVISNOYATSY-FMCGGJTJSA-N
MW364.45 g/mol
LogP3.82
Rot. Bonds7

About 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine

3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 143464743) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID143464743
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESC=C(/C=N\N(C)C)c1cnc2c(Nc3cccc(OC(C)C)c3)nccn12
InChIInChI=1S/C20H24N6O/c1-14(2)27-17-8-6-7-16(11-17)24-19-20-22-13-18(26(20)10-9-21-19)15(3)12-23-25(4)5/h6-14H,3H2,1-2,4-5H3,(H,21,24)/b23-12-
InChIKeyYHZMVISNOYATSY-FMCGGJTJSA-N
XLogP3.82
TPSA67.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine (CID 143464743) is 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine is C=C(/C=N\N(C)C)c1cnc2c(Nc3cccc(OC(C)C)c3)nccn12.
What is the InChIKey of 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is YHZMVISNOYATSY-FMCGGJTJSA-N. The full InChI is InChI=1S/C20H24N6O/c1-14(2)27-17-8-6-7-16(11-17)24-19-20-22-13-18(26(20)10-9-21-19)15(3)12-23-25(4)5/h6-14H,3H2,1-2,4-5H3,(H,21,24)/b23-12-.
What are the key properties of 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 364.45 g/mol, XLogP of 3.82, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 143464743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).