3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one

C10H15N5O — CID 106258768

IUPAC3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
SMILESCc1c(N)ncnc1NC1CCN(C)C1=O
InChIInChI=1S/C10H15N5O/c1-6-8(11)12-5-13-9(6)14-7-3-4-15(2)10(7)16/h5,7H,3-4H2,1-2H3,(H3,11,12,13,14)
InChIKeyOHLUDHHDXVKWSA-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.01
Rot. Bonds2

About 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one

3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one (PubChem CID 106258768) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one.

Molecular Properties

Compound Name3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
PubChem CID106258768
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
SMILESCc1c(N)ncnc1NC1CCN(C)C1=O
InChIInChI=1S/C10H15N5O/c1-6-8(11)12-5-13-9(6)14-7-3-4-15(2)10(7)16/h5,7H,3-4H2,1-2H3,(H3,11,12,13,14)
InChIKeyOHLUDHHDXVKWSA-UHFFFAOYSA-N
XLogP0.01
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
CID 106256788
3-[(6-ethoxy-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
CID 106258572
3-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
CID 106256817
3-[(5-bromo-6-chloropyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
CID 106257612
3-[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]-1-methylpyrrolidin-2-one
CID 106258631
1-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pyrrolidin-2-one
CID 106258791
3-amino-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]pyridine-4-carbonitrile
CID 106252122
3-[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one
CID 106258661
3-[(2-aminoquinazolin-4-yl)amino]-1-methylpyrrolidin-2-one
CID 106258511
4-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-5-methylpyrimidine-4,6-diamine
CID 80807917
4-N-(2-methoxycyclopentyl)-5-methylpyrimidine-4,6-diamine
CID 80818365
3-[(3-amino-1,2-thiazol-5-yl)amino]-1-methylpyrrolidin-2-one
CID 106259071

Frequently Asked Questions

What is the IUPAC name of 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one?
The IUPAC name of 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one (CID 106258768) is 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one.
What is the SMILES notation for 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one?
The canonical SMILES for 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one is Cc1c(N)ncnc1NC1CCN(C)C1=O.
What is the InChIKey of 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one?
The InChIKey is OHLUDHHDXVKWSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-6-8(11)12-5-13-9(6)14-7-3-4-15(2)10(7)16/h5,7H,3-4H2,1-2H3,(H3,11,12,13,14).
What are the key properties of 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one?
3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one has a molecular weight of 221.26 g/mol, XLogP of 0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-amino-5-methylpyrimidin-4-yl)amino]-1-methylpyrrolidin-2-one is sourced from PubChem (CID 106258768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).