1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one

C14H22N4O — CID 124750591

IUPAC1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one
SMILESC[C@H](Cc1cnccn1)N(C)CCN1CCCC1=O
InChIInChI=1S/C14H22N4O/c1-12(10-13-11-15-5-6-16-13)17(2)8-9-18-7-3-4-14(18)19/h5-6,11-12H,3-4,7-10H2,1-2H3/t12-/m1/s1
InChIKeyDJALCXLUSCLDFL-GFCCVEGCSA-N
MW262.36 g/mol
LogP0.96
Rot. Bonds6

About 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one

1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one (PubChem CID 124750591) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one
PubChem CID124750591
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one
SMILESC[C@H](Cc1cnccn1)N(C)CCN1CCCC1=O
InChIInChI=1S/C14H22N4O/c1-12(10-13-11-15-5-6-16-13)17(2)8-9-18-7-3-4-14(18)19/h5-6,11-12H,3-4,7-10H2,1-2H3/t12-/m1/s1
InChIKeyDJALCXLUSCLDFL-GFCCVEGCSA-N
XLogP0.96
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(pyrazin-2-ylmethylamino)propyl]pyrrolidin-2-one
CID 55109743
6-methyl-3-[2-[methyl(1-pyrazin-2-ylpropan-2-yl)amino]ethyl]-1H-pyrimidine-2,4-dione
CID 91843148
N-methyl-N-[(2S)-1-pyrazin-2-ylpropan-2-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)acetamide
CID 124852369
ethyl (2S)-2-[methyl-[2-(2-oxopyrrolidin-1-yl)ethyl]amino]propanoate
CID 95625759
4-[methyl-[2-(2-oxopyrrolidin-1-yl)ethyl]amino]pyridine-3-carboxamide
CID 133454804
7-[[methyl-[(2S)-1-pyrazin-2-ylpropan-2-yl]amino]methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 124754286
1-[2-[methyl-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]amino]ethyl]pyrrolidin-2-one
CID 96567368
N-[2-(2,4-dimethylphenoxy)ethyl]-N-methyl-1-pyrazin-2-ylpropan-2-amine
CID 91843012
N,4-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyridine-3-carboxamide
CID 130233945
1-[2-[1-(4-chlorophenyl)propan-2-yl-ethylamino]ethyl]piperidin-2-one
CID 69221614
N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
CID 91760597
N-methyl-3-(3-oxo-1H-isoindol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide
CID 91784909

Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one (CID 124750591) is 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one is C[C@H](Cc1cnccn1)N(C)CCN1CCCC1=O.
What is the InChIKey of 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one?
The InChIKey is DJALCXLUSCLDFL-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H22N4O/c1-12(10-13-11-15-5-6-16-13)17(2)8-9-18-7-3-4-14(18)19/h5-6,11-12H,3-4,7-10H2,1-2H3/t12-/m1/s1.
What are the key properties of 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one?
1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one has a molecular weight of 262.36 g/mol, XLogP of 0.96, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[methyl-[(2R)-1-pyrazin-2-ylpropan-2-yl]amino]ethyl]pyrrolidin-2-one is sourced from PubChem (CID 124750591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).