(1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine

C24H30N4 — CID 26579774

IUPAC(1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
SMILESC[C@H]1c2cccn2CCN1Cc1ccc(CN2CCn3cccc3[C@@H]2C)cc1
InChIInChI=1S/C24H30N4/c1-19-23-5-3-11-25(23)13-15-27(19)17-21-7-9-22(10-8-21)18-28-16-14-26-12-4-6-24(26)20(28)2/h3-12,19-20H,13-18H2,1-2H3/t19-,20-/m0/s1
InChIKeyAPEIFEBSZIHGDM-PMACEKPBSA-N
MW374.53 g/mol
LogP4.44
Rot. Bonds4

About (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine

(1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine (PubChem CID 26579774) has the molecular formula C24H30N4 and a molecular weight of 374.53 g/mol. Its IUPAC name is (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name(1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
PubChem CID26579774
Molecular FormulaC24H30N4
Molecular Weight374.53 g/mol
Exact Mass374.25
IUPAC Name(1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
SMILESC[C@H]1c2cccn2CCN1Cc1ccc(CN2CCn3cccc3[C@@H]2C)cc1
InChIInChI=1S/C24H30N4/c1-19-23-5-3-11-25(23)13-15-27(19)17-21-7-9-22(10-8-21)18-28-16-14-26-12-4-6-24(26)20(28)2/h3-12,19-20H,13-18H2,1-2H3/t19-,20-/m0/s1
InChIKeyAPEIFEBSZIHGDM-PMACEKPBSA-N
XLogP4.44
TPSA16.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.53
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine with MolForge

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Related Compounds

(1R)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
CID 26579777
1-methyl-2-[(4-methylphenyl)methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
CID 47010830
1-methyl-2-(3-phenylpropyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
CID 47013593
2-[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]acetamide
CID 94180479
1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-amine
CID 89009612
8-[(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methyl]quinoline
CID 18154508
2-[(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methyl]-1,3-benzothiazole
CID 17481056
2-[2-(2,6-dichlorophenoxy)ethyl]-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
CID 55411660
2-(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-pentan-3-ylacetamide
CID 18087503
(2R)-1-[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-phenylmethoxypropan-2-ol
CID 25339475
2-(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-[2-(4-propan-2-ylphenyl)ethyl]acetamide
CID 18087559
2-(4-fluorophenyl)-1-(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)ethanone
CID 47165656

Frequently Asked Questions

What is the IUPAC name of (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine?
The IUPAC name of (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine (CID 26579774) is (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine.
What is the SMILES notation for (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine?
The canonical SMILES for (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine is C[C@H]1c2cccn2CCN1Cc1ccc(CN2CCn3cccc3[C@@H]2C)cc1.
What is the InChIKey of (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine?
The InChIKey is APEIFEBSZIHGDM-PMACEKPBSA-N. The full InChI is InChI=1S/C24H30N4/c1-19-23-5-3-11-25(23)13-15-27(19)17-21-7-9-22(10-8-21)18-28-16-14-26-12-4-6-24(26)20(28)2/h3-12,19-20H,13-18H2,1-2H3/t19-,20-/m0/s1.
What are the key properties of (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine?
(1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine has a molecular weight of 374.53 g/mol, XLogP of 4.44, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-methyl-2-[[4-[[(1S)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]phenyl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 26579774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).