3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine

C17H24N4 — CID 124970525

IUPAC3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine
SMILESCN(C)c1nc([C@@H]2CCCN2CC2CC2)cn2cccc12
InChIInChI=1S/C17H24N4/c1-19(2)17-16-6-4-10-21(16)12-14(18-17)15-5-3-9-20(15)11-13-7-8-13/h4,6,10,12-13,15H,3,5,7-9,11H2,1-2H3/t15-/m0/s1
InChIKeyJQQAGPMPXAINOK-HNNXBMFYSA-N
MW284.41 g/mol
LogP2.95
Rot. Bonds4

About 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine

3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine (PubChem CID 124970525) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine.

Molecular Properties

Compound Name3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine
PubChem CID124970525
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine
SMILESCN(C)c1nc([C@@H]2CCCN2CC2CC2)cn2cccc12
InChIInChI=1S/C17H24N4/c1-19(2)17-16-6-4-10-21(16)12-14(18-17)15-5-3-9-20(15)11-13-7-8-13/h4,6,10,12-13,15H,3,5,7-9,11H2,1-2H3/t15-/m0/s1
InChIKeyJQQAGPMPXAINOK-HNNXBMFYSA-N
XLogP2.95
TPSA23.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine?
The IUPAC name of 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine (CID 124970525) is 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine.
What is the SMILES notation for 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine?
The canonical SMILES for 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine is CN(C)c1nc([C@@H]2CCCN2CC2CC2)cn2cccc12.
What is the InChIKey of 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine?
The InChIKey is JQQAGPMPXAINOK-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H24N4/c1-19(2)17-16-6-4-10-21(16)12-14(18-17)15-5-3-9-20(15)11-13-7-8-13/h4,6,10,12-13,15H,3,5,7-9,11H2,1-2H3/t15-/m0/s1.
What are the key properties of 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine?
3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine has a molecular weight of 284.41 g/mol, XLogP of 2.95, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-N,N-dimethylpyrrolo[1,2-a]pyrazin-1-amine is sourced from PubChem (CID 124970525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).