1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide

C11H16N4O — CID 110269417

IUPAC1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide
SMILESCc1nccc(N2CCCCC2C(N)=O)n1
InChIInChI=1S/C11H16N4O/c1-8-13-6-5-10(14-8)15-7-3-2-4-9(15)11(12)16/h5-6,9H,2-4,7H2,1H3,(H2,12,16)
InChIKeyKQWVVSUNSKMITM-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.63
Rot. Bonds2

About 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide

1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide (PubChem CID 110269417) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide
PubChem CID110269417
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide
SMILESCc1nccc(N2CCCCC2C(N)=O)n1
InChIInChI=1S/C11H16N4O/c1-8-13-6-5-10(14-8)15-7-3-2-4-9(15)11(12)16/h5-6,9H,2-4,7H2,1H3,(H2,12,16)
InChIKeyKQWVVSUNSKMITM-UHFFFAOYSA-N
XLogP0.63
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-1-(2-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 94586857
(2R)-1-(2-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 94586856
3-[1-(2-methylpyrimidin-4-yl)piperidin-2-yl]propanoic acid
CID 62785287
methyl 2-[1-(2-methylpyrimidin-4-yl)piperidin-2-yl]acetate
CID 62771827
1-[2-(dimethylamino)pyrimidin-4-yl]piperidine-2-carboxylic acid
CID 64831026
[1-(2-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 62770947
2-[(2S)-1-(2-methylpyrimidin-4-yl)pyrrolidin-2-yl]-1,3-thiazole-5-carboxamide
CID 124940784
1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80806267
1-(5-amino-6-cyano-2-pyridinyl)piperidine-2-carboxamide
CID 103467973
4-ethyl-1-(2-methylpyrimidin-4-yl)piperidine-2-carboxylic acid
CID 114427599
1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidine-2-carboxamide
CID 62868559
methanamine;2-methyl-4-pyrrolidin-1-ylpyrimidine
CID 143912521

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide?
The IUPAC name of 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide (CID 110269417) is 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide.
What is the SMILES notation for 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide?
The canonical SMILES for 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide is Cc1nccc(N2CCCCC2C(N)=O)n1.
What is the InChIKey of 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide?
The InChIKey is KQWVVSUNSKMITM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-8-13-6-5-10(14-8)15-7-3-2-4-9(15)11(12)16/h5-6,9H,2-4,7H2,1H3,(H2,12,16).
What are the key properties of 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide?
1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide has a molecular weight of 220.28 g/mol, XLogP of 0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrimidin-4-yl)piperidine-2-carboxamide is sourced from PubChem (CID 110269417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).