1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide

C15H24N4O — CID 655911

IUPAC1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(c2nc(C)cc(C)n2)CC1
InChIInChI=1S/C15H24N4O/c1-4-7-16-14(20)13-5-8-19(9-6-13)15-17-11(2)10-12(3)18-15/h10,13H,4-9H2,1-3H3,(H,16,20)
InChIKeyVIFJYVAUWYBNTN-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.84
Rot. Bonds4

About 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide

1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide (PubChem CID 655911) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide
PubChem CID655911
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(c2nc(C)cc(C)n2)CC1
InChIInChI=1S/C15H24N4O/c1-4-7-16-14(20)13-5-8-19(9-6-13)15-17-11(2)10-12(3)18-15/h10,13H,4-9H2,1-3H3,(H,16,20)
InChIKeyVIFJYVAUWYBNTN-UHFFFAOYSA-N
XLogP1.84
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide?
The IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide (CID 655911) is 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide?
The canonical SMILES for 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide is CCCNC(=O)C1CCN(c2nc(C)cc(C)n2)CC1.
What is the InChIKey of 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide?
The InChIKey is VIFJYVAUWYBNTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-4-7-16-14(20)13-5-8-19(9-6-13)15-17-11(2)10-12(3)18-15/h10,13H,4-9H2,1-3H3,(H,16,20).
What are the key properties of 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide?
1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethylpyrimidin-2-yl)-N-propylpiperidine-4-carboxamide is sourced from PubChem (CID 655911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).