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

C17H28N4O — CID 53181523

IUPACN-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide
SMILESCc1nc(C(=O)NC2CCCC2)c(C)n1C1CCN(C)CC1
InChIInChI=1S/C17H28N4O/c1-12-16(17(22)19-14-6-4-5-7-14)18-13(2)21(12)15-8-10-20(3)11-9-15/h14-15H,4-11H2,1-3H3,(H,19,22)
InChIKeyDGWQGFMFVMTDFW-UHFFFAOYSA-N
MW304.44 g/mol
LogP2.44
Rot. Bonds3

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

N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide (PubChem CID 53181523) has the molecular formula C17H28N4O and a molecular weight of 304.44 g/mol. Its IUPAC name is N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide
PubChem CID53181523
Molecular FormulaC17H28N4O
Molecular Weight304.44 g/mol
Exact Mass304.23
IUPAC NameN-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide
SMILESCc1nc(C(=O)NC2CCCC2)c(C)n1C1CCN(C)CC1
InChIInChI=1S/C17H28N4O/c1-12-16(17(22)19-14-6-4-5-7-14)18-13(2)21(12)15-8-10-20(3)11-9-15/h14-15H,4-11H2,1-3H3,(H,19,22)
InChIKeyDGWQGFMFVMTDFW-UHFFFAOYSA-N
XLogP2.44
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide?
The IUPAC name of N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide (CID 53181523) is N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide?
The canonical SMILES for N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide is Cc1nc(C(=O)NC2CCCC2)c(C)n1C1CCN(C)CC1.
What is the InChIKey of N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide?
The InChIKey is DGWQGFMFVMTDFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O/c1-12-16(17(22)19-14-6-4-5-7-14)18-13(2)21(12)15-8-10-20(3)11-9-15/h14-15H,4-11H2,1-3H3,(H,19,22).
What are the key properties of N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide?
N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide has a molecular weight of 304.44 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2,5-dimethyl-1-(1-methylpiperidin-4-yl)imidazole-4-carboxamide is sourced from PubChem (CID 53181523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).