N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide

C24H26N4O2 — CID 90492929

IUPACN-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide
SMILESO=C(NCC(=O)N1CCC(Cn2ccnc2-c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C24H26N4O2/c29-22(17-26-24(30)21-9-5-2-6-10-21)27-14-11-19(12-15-27)18-28-16-13-25-23(28)20-7-3-1-4-8-20/h1-10,13,16,19H,11-12,14-15,17-18H2,(H,26,30)
InChIKeyWTRRDQPINSOIMY-UHFFFAOYSA-N
MW402.50 g/mol
LogP3.22
Rot. Bonds6

About N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide

N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide (PubChem CID 90492929) has the molecular formula C24H26N4O2 and a molecular weight of 402.50 g/mol. Its IUPAC name is N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide.

Molecular Properties

Compound NameN-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide
PubChem CID90492929
Molecular FormulaC24H26N4O2
Molecular Weight402.50 g/mol
Exact Mass402.21
IUPAC NameN-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide
SMILESO=C(NCC(=O)N1CCC(Cn2ccnc2-c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C24H26N4O2/c29-22(17-26-24(30)21-9-5-2-6-10-21)27-14-11-19(12-15-27)18-28-16-13-25-23(28)20-7-3-1-4-8-20/h1-10,13,16,19H,11-12,14-15,17-18H2,(H,26,30)
InChIKeyWTRRDQPINSOIMY-UHFFFAOYSA-N
XLogP3.22
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.50
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]propan-1-one
CID 90492944
N-[2-[4-(imidazol-1-ylmethyl)piperidin-1-yl]-2-oxoethyl]benzamide
CID 90492606
1-(4-chlorophenyl)-4-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]butane-1,4-dione
CID 90492938
N-[(4-fluorophenyl)methyl]-4-[(2-phenylimidazol-1-yl)methyl]piperidine-1-carboxamide
CID 90494541
1-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]-2-(4-propan-2-ylsulfonylphenyl)ethanone
CID 90492931
4-[(2-phenylimidazol-1-yl)methyl]-N-[2-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 90494539
N-[2-(4-benzamidopiperidin-1-yl)-2-oxoethyl]benzamide
CID 34423890
[3-(2-methylpropoxy)phenyl]-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]methanone
CID 90493030
N-methyl-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 90494467
N-[2-[4-(methylsulfonylmethyl)piperidin-1-yl]-2-oxoethyl]benzamide
CID 110745924
2-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethanone
CID 90492933
2-methyl-6-[4-[(2-phenylimidazol-1-yl)methyl]piperidine-1-carbonyl]pyridazin-3-one
CID 71781081

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide?
The IUPAC name of N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide (CID 90492929) is N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide.
What is the SMILES notation for N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide?
The canonical SMILES for N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide is O=C(NCC(=O)N1CCC(Cn2ccnc2-c2ccccc2)CC1)c1ccccc1.
What is the InChIKey of N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide?
The InChIKey is WTRRDQPINSOIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O2/c29-22(17-26-24(30)21-9-5-2-6-10-21)27-14-11-19(12-15-27)18-28-16-13-25-23(28)20-7-3-1-4-8-20/h1-10,13,16,19H,11-12,14-15,17-18H2,(H,26,30).
What are the key properties of N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide?
N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide has a molecular weight of 402.50 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethyl]benzamide is sourced from PubChem (CID 90492929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).