(4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone

C22H27N3O3 — CID 46964656

IUPAC(4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
SMILESCOc1ccc(OC)c2c1cc(C(=O)N1CCn3cccc3C1C(C)C)n2C
InChIInChI=1S/C22H27N3O3/c1-14(2)20-16-7-6-10-24(16)11-12-25(20)22(26)17-13-15-18(27-4)8-9-19(28-5)21(15)23(17)3/h6-10,13-14,20H,11-12H2,1-5H3
InChIKeyHEHYAGKYHXQFJD-UHFFFAOYSA-N
MW381.48 g/mol
LogP3.85
Rot. Bonds4

About (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone

(4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone (PubChem CID 46964656) has the molecular formula C22H27N3O3 and a molecular weight of 381.48 g/mol. Its IUPAC name is (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone.

Molecular Properties

Compound Name(4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
PubChem CID46964656
Molecular FormulaC22H27N3O3
Molecular Weight381.48 g/mol
Exact Mass381.21
IUPAC Name(4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
SMILESCOc1ccc(OC)c2c1cc(C(=O)N1CCn3cccc3C1C(C)C)n2C
InChIInChI=1S/C22H27N3O3/c1-14(2)20-16-7-6-10-24(16)11-12-25(20)22(26)17-13-15-18(27-4)8-9-19(28-5)21(15)23(17)3/h6-10,13-14,20H,11-12H2,1-5H3
InChIKeyHEHYAGKYHXQFJD-UHFFFAOYSA-N
XLogP3.85
TPSA48.63 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone with MolForge

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Launch Full Analysis

Related Compounds

N-(5-chloro-2-methoxyphenyl)-1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
CID 20965172
(4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone
CID 86207297
4,7-dimethoxy-1-methylindole-2-carboxylate
CID 6953965
methyl 4,7-dimethoxy-1-methylindole-2-carboxylate
CID 4777665
[(1S)-1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-(5-methoxy-1-methylindol-2-yl)methanone
CID 97156148
(1S)-N-(2,5-dimethylphenyl)-1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
CID 92712035
methyl 3-[[(1S)-1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl]amino]thiophene-2-carboxylate
CID 92712057
(1R)-N-(4-bromo-3-methylphenyl)-1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
CID 92725847
(1-methoxyisoquinolin-3-yl)-[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methanone
CID 95151150
1-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-quinazolin-4-yloxyethanone
CID 46964650
(2S)-2-[[(2S)-2-[(4,7-dimethoxy-1-methylindole-2-carbonyl)amino]propanoyl]amino]propanoic acid
CID 7070161
(2-methoxyphenyl)-[1-(2-methoxyphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methanone
CID 24859265

Frequently Asked Questions

What is the IUPAC name of (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone?
The IUPAC name of (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone (CID 46964656) is (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone.
What is the SMILES notation for (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone?
The canonical SMILES for (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone is COc1ccc(OC)c2c1cc(C(=O)N1CCn3cccc3C1C(C)C)n2C.
What is the InChIKey of (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone?
The InChIKey is HEHYAGKYHXQFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O3/c1-14(2)20-16-7-6-10-24(16)11-12-25(20)22(26)17-13-15-18(27-4)8-9-19(28-5)21(15)23(17)3/h6-10,13-14,20H,11-12H2,1-5H3.
What are the key properties of (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone?
(4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone has a molecular weight of 381.48 g/mol, XLogP of 3.85, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4,7-dimethoxy-1-methylindol-2-yl)-(1-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone is sourced from PubChem (CID 46964656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).