1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide

C12H19N5O — CID 80806267

IUPAC1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide
SMILESCc1nc(N)c(C)c(N2CCCCC2C(N)=O)n1
InChIInChI=1S/C12H19N5O/c1-7-10(13)15-8(2)16-12(7)17-6-4-3-5-9(17)11(14)18/h9H,3-6H2,1-2H3,(H2,14,18)(H2,13,15,16)
InChIKeyCCBCWFISSZXWMU-UHFFFAOYSA-N
MW249.32 g/mol
LogP0.52
Rot. Bonds2

About 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide

1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide (PubChem CID 80806267) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide
PubChem CID80806267
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC Name1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide
SMILESCc1nc(N)c(C)c(N2CCCCC2C(N)=O)n1
InChIInChI=1S/C12H19N5O/c1-7-10(13)15-8(2)16-12(7)17-6-4-3-5-9(17)11(14)18/h9H,3-6H2,1-2H3,(H2,14,18)(H2,13,15,16)
InChIKeyCCBCWFISSZXWMU-UHFFFAOYSA-N
XLogP0.52
TPSA98.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(6-amino-2-ethyl-5-methylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80986918
1-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80994949
1-(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-N-methylpiperidine-2-carboxamide
CID 80986924
1-(6-amino-5-methyl-2-propylpyrimidin-4-yl)-N-methylpiperidine-2-carboxamide
CID 80986923
1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide
CID 110269417
1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80987630
4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105267
1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxamide
CID 103323978
1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide
CID 81000899
1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidine-2-carboxamide
CID 62868559
1-(3-methyl-1,2,4-thiadiazol-5-yl)pyrrolidine-2-carboxamide
CID 133424929
1-(6-chloro-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide
CID 63736298

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide?
The IUPAC name of 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide (CID 80806267) is 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide.
What is the SMILES notation for 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide?
The canonical SMILES for 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide is Cc1nc(N)c(C)c(N2CCCCC2C(N)=O)n1.
What is the InChIKey of 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide?
The InChIKey is CCBCWFISSZXWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-7-10(13)15-8(2)16-12(7)17-6-4-3-5-9(17)11(14)18/h9H,3-6H2,1-2H3,(H2,14,18)(H2,13,15,16).
What are the key properties of 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide?
1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide has a molecular weight of 249.32 g/mol, XLogP of 0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide is sourced from PubChem (CID 80806267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).