1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine

C19H23N3O — CID 15662174

IUPAC1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine
SMILESCOc1ccc(CCc2nccn3c(CN(C)C)ccc23)cc1
InChIInChI=1S/C19H23N3O/c1-21(2)14-16-7-11-19-18(20-12-13-22(16)19)10-6-15-4-8-17(23-3)9-5-15/h4-5,7-9,11-13H,6,10,14H2,1-3H3
InChIKeyDFLRZUORHVAZPY-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.19
Rot. Bonds6

About 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine

1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine (PubChem CID 15662174) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine
PubChem CID15662174
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC Name1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine
SMILESCOc1ccc(CCc2nccn3c(CN(C)C)ccc23)cc1
InChIInChI=1S/C19H23N3O/c1-21(2)14-16-7-11-19-18(20-12-13-22(16)19)10-6-15-4-8-17(23-3)9-5-15/h4-5,7-9,11-13H,6,10,14H2,1-3H3
InChIKeyDFLRZUORHVAZPY-UHFFFAOYSA-N
XLogP3.19
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[2-(4-methoxyphenyl)ethyl]phenoxy]-N,N-dimethylethanamine
CID 171715461
CID 174019558
CID 174019558
4-methoxy-N-[(4-methoxyphenyl)methyl]-N-methylpyrimidin-2-amine
CID 165433420
2-[2-[2-(4-methoxyphenyl)ethyl]imidazol-1-yl]ethanol
CID 82560023
1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine
CID 164696378
6-bromo-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[1,2-a]pyrazin-8-amine
CID 79953825
3-[2-(4-methoxyphenyl)ethyl]-1,4-dimethylpyrazole
CID 155131154
N-[(1-ethylimidazol-2-yl)methyl]-2-(4-methoxyphenyl)ethanamine
CID 46784377
1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 115860096
ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine
CID 142950158
2-[2-(4-methoxyphenyl)ethyl-methylamino]pyrimidine-4-carbonitrile
CID 163348210
1-(difluoromethoxy)-4-[2-(4-methoxyphenyl)ethyl]benzene
CID 19436013

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine (CID 15662174) is 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine is COc1ccc(CCc2nccn3c(CN(C)C)ccc23)cc1.
What is the InChIKey of 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine?
The InChIKey is DFLRZUORHVAZPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-21(2)14-16-7-11-19-18(20-12-13-22(16)19)10-6-15-4-8-17(23-3)9-5-15/h4-5,7-9,11-13H,6,10,14H2,1-3H3.
What are the key properties of 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine?
1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine has a molecular weight of 309.41 g/mol, XLogP of 3.19, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(4-methoxyphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 15662174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).