2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide

C15H26N4O — CID 53181518

IUPAC2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide
SMILESCCCNC(=O)c1nc(C)n(C2CCN(C)CC2)c1C
InChIInChI=1S/C15H26N4O/c1-5-8-16-15(20)14-11(2)19(12(3)17-14)13-6-9-18(4)10-7-13/h13H,5-10H2,1-4H3,(H,16,20)
InChIKeyRSZHJSABRJBJHP-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.91
Rot. Bonds4

About 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide

2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide (PubChem CID 53181518) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide
PubChem CID53181518
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide
SMILESCCCNC(=O)c1nc(C)n(C2CCN(C)CC2)c1C
InChIInChI=1S/C15H26N4O/c1-5-8-16-15(20)14-11(2)19(12(3)17-14)13-6-9-18(4)10-7-13/h13H,5-10H2,1-4H3,(H,16,20)
InChIKeyRSZHJSABRJBJHP-UHFFFAOYSA-N
XLogP1.91
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide?
The IUPAC name of 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide (CID 53181518) is 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide.
What is the SMILES notation for 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide?
The canonical SMILES for 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide is CCCNC(=O)c1nc(C)n(C2CCN(C)CC2)c1C.
What is the InChIKey of 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide?
The InChIKey is RSZHJSABRJBJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-5-8-16-15(20)14-11(2)19(12(3)17-14)13-6-9-18(4)10-7-13/h13H,5-10H2,1-4H3,(H,16,20).
What are the key properties of 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide?
2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide is sourced from PubChem (CID 53181518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).