N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide

C15H25N3O2 — CID 91923972

IUPACN-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide
SMILESCc1cnc(CCNC(=O)C2CCOCC2)n1C(C)C
InChIInChI=1S/C15H25N3O2/c1-11(2)18-12(3)10-17-14(18)4-7-16-15(19)13-5-8-20-9-6-13/h10-11,13H,4-9H2,1-3H3,(H,16,19)
InChIKeyCZJXKDLENVFGOO-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.86
Rot. Bonds5

About N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide

N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide (PubChem CID 91923972) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide
PubChem CID91923972
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide
SMILESCc1cnc(CCNC(=O)C2CCOCC2)n1C(C)C
InChIInChI=1S/C15H25N3O2/c1-11(2)18-12(3)10-17-14(18)4-7-16-15(19)13-5-8-20-9-6-13/h10-11,13H,4-9H2,1-3H3,(H,16,19)
InChIKeyCZJXKDLENVFGOO-UHFFFAOYSA-N
XLogP1.86
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-pyridin-2-ylethyl)oxane-4-carboxamide
CID 51073128
N-(3-methylbutyl)oxane-4-carboxamide
CID 51110017
4-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]morpholine
CID 117188539
N-[2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethyl]cyclohexanecarboxamide
CID 53143762
N-(4-pyridin-2-ylbutyl)oxane-4-carboxamide
CID 118773857
N-[2-(3-propan-2-ylphenoxy)ethyl]oxane-4-carboxamide
CID 113100261
N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide
CID 51220547
4-(2-hydroxypropan-2-yl)-N-[2-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]cyclohexane-1-carboxamide
CID 167819502
3-amino-N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]cyclopentane-1-carboxamide
CID 119888825
N-(2-aminopropyl)oxane-4-carboxamide
CID 15035314
N-[2-(4-fluorophenyl)ethyl]-1-(oxane-4-carbonyl)piperidine-4-carboxamide
CID 113004684
N-[3-[(5-methyl-2-pyridinyl)amino]propyl]oxolane-3-carboxamide
CID 131922621

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide?
The IUPAC name of N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide (CID 91923972) is N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide.
What is the SMILES notation for N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide?
The canonical SMILES for N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide is Cc1cnc(CCNC(=O)C2CCOCC2)n1C(C)C.
What is the InChIKey of N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide?
The InChIKey is CZJXKDLENVFGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-11(2)18-12(3)10-17-14(18)4-7-16-15(19)13-5-8-20-9-6-13/h10-11,13H,4-9H2,1-3H3,(H,16,19).
What are the key properties of N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide?
N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methyl-1-propan-2-ylimidazol-2-yl)ethyl]oxane-4-carboxamide is sourced from PubChem (CID 91923972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).