N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide

C18H24N4O — CID 56891324

IUPACN-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide
SMILESCCN1CCCC(c2nccn2-c2cccc(NC(C)=O)c2)C1
InChIInChI=1S/C18H24N4O/c1-3-21-10-5-6-15(13-21)18-19-9-11-22(18)17-8-4-7-16(12-17)20-14(2)23/h4,7-9,11-12,15H,3,5-6,10,13H2,1-2H3,(H,20,23)
InChIKeyDEBSZWOWQNHDIC-UHFFFAOYSA-N
MW312.42 g/mol
LogP3.03
Rot. Bonds4

About N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide

N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide (PubChem CID 56891324) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide
PubChem CID56891324
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC NameN-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide
SMILESCCN1CCCC(c2nccn2-c2cccc(NC(C)=O)c2)C1
InChIInChI=1S/C18H24N4O/c1-3-21-10-5-6-15(13-21)18-19-9-11-22(18)17-8-4-7-16(12-17)20-14(2)23/h4,7-9,11-12,15H,3,5-6,10,13H2,1-2H3,(H,20,23)
InChIKeyDEBSZWOWQNHDIC-UHFFFAOYSA-N
XLogP3.03
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]quinoline
CID 56911370
N-[3-(2-aminoimidazol-1-yl)phenyl]acetamide
CID 106558064
N-[3-[1-(1-ethylpiperidin-3-yl)ethylamino]phenyl]acetamide
CID 43307791
2-[(3R)-3-[3-(3-acetamidophenyl)pyrazin-2-yl]piperidin-1-yl]-N,N-dimethylacetamide
CID 95819119
N-[3-[3-[(3R)-1-benzylpiperidin-3-yl]pyrazin-2-yl]phenyl]acetamide
CID 95818594
1-(3,4-dichlorophenyl)-3-(1-ethylpiperidin-3-yl)urea
CID 47349344
1-ethyl-N-(1-phenylimidazol-2-yl)piperidin-3-amine
CID 106565174
N-[3-[3-[(3R)-1-(2-phenoxyethyl)piperidin-3-yl]pyrazin-2-yl]phenyl]acetamide
CID 95819133
N-[3-[3-[(3S)-1-(2-hydroxyacetyl)piperidin-3-yl]pyrazin-2-yl]phenyl]acetamide
CID 95819324
N-[4-[[(3S)-3-[3-(3-chlorophenyl)pyrazin-2-yl]piperidin-1-yl]methyl]phenyl]acetamide
CID 95819285
(3R)-N-(1,3-benzodioxol-5-yl)-3-(1-ethylimidazol-2-yl)piperidine-1-carboxamide
CID 97143036
N-(1,3-benzodioxol-5-yl)-3-(1-ethylimidazol-2-yl)piperidine-1-carboxamide
CID 70765081

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide?
The IUPAC name of N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide (CID 56891324) is N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide is CCN1CCCC(c2nccn2-c2cccc(NC(C)=O)c2)C1.
What is the InChIKey of N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide?
The InChIKey is DEBSZWOWQNHDIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-3-21-10-5-6-15(13-21)18-19-9-11-22(18)17-8-4-7-16(12-17)20-14(2)23/h4,7-9,11-12,15H,3,5-6,10,13H2,1-2H3,(H,20,23).
What are the key properties of N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide?
N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide has a molecular weight of 312.42 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]phenyl]acetamide is sourced from PubChem (CID 56891324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).