N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide

C14H24N4O — CID 106719093

IUPACN-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide
SMILESCCCNCc1cn(CC(=O)N(CC)C2CC2)cn1
InChIInChI=1S/C14H24N4O/c1-3-7-15-8-12-9-17(11-16-12)10-14(19)18(4-2)13-5-6-13/h9,11,13,15H,3-8,10H2,1-2H3
InChIKeyWQEQOBPYHLPEBY-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.39
Rot. Bonds8

About N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide

N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide (PubChem CID 106719093) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide
PubChem CID106719093
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide
SMILESCCCNCc1cn(CC(=O)N(CC)C2CC2)cn1
InChIInChI=1S/C14H24N4O/c1-3-7-15-8-12-9-17(11-16-12)10-14(19)18(4-2)13-5-6-13/h9,11,13,15H,3-8,10H2,1-2H3
InChIKeyWQEQOBPYHLPEBY-UHFFFAOYSA-N
XLogP1.39
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]-N-methylacetamide
CID 106720377
methyl 2-[4-(propylaminomethyl)imidazol-1-yl]acetate
CID 106719124
N-cyclopropyl-2-[4-[(cyclopropylamino)methyl]imidazol-1-yl]-N-methylacetamide
CID 106719702
2-[4-[(cyclopropylamino)methyl]imidazol-1-yl]-N,N-dimethylacetamide
CID 106719907
N-cyclopropyl-2-[4-(ethylaminomethyl)imidazol-1-yl]acetamide
CID 106718782
5-[4-(propylaminomethyl)imidazol-1-yl]pentanamide
CID 114281742
N-[[1-[2-(dimethylamino)ethyl]imidazol-4-yl]methyl]propan-1-amine
CID 106719181
N-[[1-(oxolan-2-ylmethyl)imidazol-4-yl]methyl]propan-1-amine
CID 106719035
3-[4-(propylaminomethyl)imidazol-1-yl]propane-1,2-diol
CID 106719229
N-cyclopropyl-N-ethyl-2-[3-(methylaminomethyl)pyrrol-1-yl]acetamide
CID 66406717
N-cyclopropyl-N-ethyl-2-[4-[(2-methylpropylamino)methyl]triazol-1-yl]acetamide
CID 66192880
N-[[1-[(5,5-dimethyloxolan-2-yl)methyl]imidazol-4-yl]methyl]propan-1-amine
CID 106719072

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide (CID 106719093) is N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide is CCCNCc1cn(CC(=O)N(CC)C2CC2)cn1.
What is the InChIKey of N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide?
The InChIKey is WQEQOBPYHLPEBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-7-15-8-12-9-17(11-16-12)10-14(19)18(4-2)13-5-6-13/h9,11,13,15H,3-8,10H2,1-2H3.
What are the key properties of N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide?
N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.39, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-2-[4-(propylaminomethyl)imidazol-1-yl]acetamide is sourced from PubChem (CID 106719093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).