1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide

C12H17N5O2 — CID 114770103

IUPAC1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide
SMILESCc1cc(C(N)=O)cc(N2CCNCC2C(N)=O)n1
InChIInChI=1S/C12H17N5O2/c1-7-4-8(11(13)18)5-10(16-7)17-3-2-15-6-9(17)12(14)19/h4-5,9,15H,2-3,6H2,1H3,(H2,13,18)(H2,14,19)
InChIKeyCUYHONYKTUSXPY-UHFFFAOYSA-N
MW263.30 g/mol
LogP-1.25
Rot. Bonds3

About 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide

1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide (PubChem CID 114770103) has the molecular formula C12H17N5O2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide.

Molecular Properties

Compound Name1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide
PubChem CID114770103
Molecular FormulaC12H17N5O2
Molecular Weight263.30 g/mol
Exact Mass263.14
IUPAC Name1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide
SMILESCc1cc(C(N)=O)cc(N2CCNCC2C(N)=O)n1
InChIInChI=1S/C12H17N5O2/c1-7-4-8(11(13)18)5-10(16-7)17-3-2-15-6-9(17)12(14)19/h4-5,9,15H,2-3,6H2,1H3,(H2,13,18)(H2,14,19)
InChIKeyCUYHONYKTUSXPY-UHFFFAOYSA-N
XLogP-1.25
TPSA114.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-1.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-carbamoylpiperazin-1-yl)-2-chloropyrimidine-4-carboxamide;hydrochloride
CID 89422597
1-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazine-2-carboxamide
CID 114787140
(2R)-1-(2-chloro-6-methylpyrimidin-4-yl)piperazine-2-carboxylic acid
CID 97162747
2-methyl-6-(4-methyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)pyridine-4-carboxamide
CID 114770138
1-(4-cyano-6-methyl-2-pyridinyl)-N-methylpiperazine-2-carboxamide
CID 114770105
1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperazine-2-carboxamide
CID 104732644
1-(6-fluoro-1H-benzimidazol-2-yl)piperazine-2-carboxamide
CID 103295287
N-ethyl-1-(6-methoxy-2-methylpyrimidin-4-yl)piperazine-2-carboxamide
CID 66333888
N-methyl-1-(2-methyl-6-oxo-1H-pyrimidin-4-yl)piperazine-2-carboxamide
CID 136989399
2-(4-carbamoyl-6-methyl-2-pyridinyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxylic acid
CID 102892397
1-[(6-methyl-2-pyridinyl)methyl]piperazine-2-carboxamide
CID 79261566
2-[4-(1-aminoethyl)piperidin-1-yl]-6-methylpyridine-4-carboxamide
CID 114770036

Frequently Asked Questions

What is the IUPAC name of 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide?
The IUPAC name of 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide (CID 114770103) is 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide.
What is the SMILES notation for 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide?
The canonical SMILES for 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide is Cc1cc(C(N)=O)cc(N2CCNCC2C(N)=O)n1.
What is the InChIKey of 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide?
The InChIKey is CUYHONYKTUSXPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2/c1-7-4-8(11(13)18)5-10(16-7)17-3-2-15-6-9(17)12(14)19/h4-5,9,15H,2-3,6H2,1H3,(H2,13,18)(H2,14,19).
What are the key properties of 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide?
1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide has a molecular weight of 263.30 g/mol, XLogP of -1.25, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-carbamoyl-6-methyl-2-pyridinyl)piperazine-2-carboxamide is sourced from PubChem (CID 114770103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).