6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide

C15H21N5O2 — CID 122298657

IUPAC6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide
SMILESO=C1CCC(C(=O)Nc2cnc(N3CCCCC3)nc2)CN1
InChIInChI=1S/C15H21N5O2/c21-13-5-4-11(8-16-13)14(22)19-12-9-17-15(18-10-12)20-6-2-1-3-7-20/h9-11H,1-8H2,(H,16,21)(H,19,22)
InChIKeyRJVKZACMONJJGA-UHFFFAOYSA-N
MW303.37 g/mol
LogP0.93
Rot. Bonds3

About 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide

6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide (PubChem CID 122298657) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide
PubChem CID122298657
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide
SMILESO=C1CCC(C(=O)Nc2cnc(N3CCCCC3)nc2)CN1
InChIInChI=1S/C15H21N5O2/c21-13-5-4-11(8-16-13)14(22)19-12-9-17-15(18-10-12)20-6-2-1-3-7-20/h9-11H,1-8H2,(H,16,21)(H,19,22)
InChIKeyRJVKZACMONJJGA-UHFFFAOYSA-N
XLogP0.93
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(6-oxopiperidine-3-carbonyl)amino]pyridine-2-carboxylic acid
CID 83192913
N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-6-oxopiperidine-3-carboxamide
CID 122356657
N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide
CID 112728864
(3R)-N-(5-chloro-2-piperidin-1-ylphenyl)-6-oxopiperidine-3-carboxamide
CID 97076746
2-[4-[(6-oxopiperidine-3-carbonyl)amino]pyrazol-1-yl]acetic acid
CID 83192588
N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-6-oxopiperidine-3-carboxamide
CID 112731492
5-(azocane-1-carbonyl)piperidin-2-one
CID 112728799
5-(azepane-1-carbonyl)piperidin-2-one
CID 112728735
N-(4-tert-butylphenyl)-6-oxopiperidine-3-carboxamide
CID 78272138
N-[2-(4-phenylpiperazin-1-yl)pyrimidin-5-yl]cyclobutanecarboxamide
CID 122299328
N-(3,4-difluorophenyl)-6-oxopiperidine-3-carboxamide
CID 78594911
N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-6-oxopiperidine-3-carboxamide
CID 51083310

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide?
The IUPAC name of 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide (CID 122298657) is 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide is O=C1CCC(C(=O)Nc2cnc(N3CCCCC3)nc2)CN1.
What is the InChIKey of 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide?
The InChIKey is RJVKZACMONJJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c21-13-5-4-11(8-16-13)14(22)19-12-9-17-15(18-10-12)20-6-2-1-3-7-20/h9-11H,1-8H2,(H,16,21)(H,19,22).
What are the key properties of 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide?
6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 0.93, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide is sourced from PubChem (CID 122298657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).