N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide

C23H28N4O2 — CID 166062569

IUPACN-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
SMILESO=C1NCC(C(=O)NCc2ccc(Nc3ccc(C4CCCCC4)cc3)cc2)N1
InChIInChI=1S/C23H28N4O2/c28-22(21-15-25-23(29)27-21)24-14-16-6-10-19(11-7-16)26-20-12-8-18(9-13-20)17-4-2-1-3-5-17/h6-13,17,21,26H,1-5,14-15H2,(H,24,28)(H2,25,27,29)
InChIKeyUQDAAMXARXUORN-UHFFFAOYSA-N
MW392.50 g/mol
LogP3.78
Rot. Bonds6

About N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide

N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide (PubChem CID 166062569) has the molecular formula C23H28N4O2 and a molecular weight of 392.50 g/mol. Its IUPAC name is N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
PubChem CID166062569
Molecular FormulaC23H28N4O2
Molecular Weight392.50 g/mol
Exact Mass392.22
IUPAC NameN-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
SMILESO=C1NCC(C(=O)NCc2ccc(Nc3ccc(C4CCCCC4)cc3)cc2)N1
InChIInChI=1S/C23H28N4O2/c28-22(21-15-25-23(29)27-21)24-14-16-6-10-19(11-7-16)26-20-12-8-18(9-13-20)17-4-2-1-3-5-17/h6-13,17,21,26H,1-5,14-15H2,(H,24,28)(H2,25,27,29)
InChIKeyUQDAAMXARXUORN-UHFFFAOYSA-N
XLogP3.78
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 53.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-[4-(4,4-dimethylcyclohexyl)anilino]phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
CID 166062066
N-[[4-[4-(4-methylpiperidin-1-yl)anilino]phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
CID 166062307
2-oxo-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]imidazolidine-4-carboxamide
CID 71877710
N-[(4-cyclopentylphenyl)methyl]acetamide
CID 66695215
1-[(4-cyclohexylphenyl)methyl]-3-methylurea
CID 115169108
N-[(3-bromo-5-fluorophenyl)methyl]-2-oxoimidazolidine-4-carboxamide
CID 71877841
(4R)-2-oxo-N-[[3-(phenoxymethyl)phenyl]methyl]imidazolidine-4-carboxamide
CID 97082817
(4S)-N-[[2-[[(2R)-2-methylpiperidin-1-yl]methyl]phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
CID 97092356
N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
CID 71877885
N-[(4-fluorophenyl)methyl]-7-oxoazepane-2-carboxamide
CID 110196319
methyl 2-(4-cycloheptylphenyl)acetate
CID 54417181
N-[(4-cyclopentylphenyl)methyl]hydroxylamine
CID 117282542

Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide?
The IUPAC name of N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide (CID 166062569) is N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide.
What is the SMILES notation for N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide?
The canonical SMILES for N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide is O=C1NCC(C(=O)NCc2ccc(Nc3ccc(C4CCCCC4)cc3)cc2)N1.
What is the InChIKey of N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide?
The InChIKey is UQDAAMXARXUORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O2/c28-22(21-15-25-23(29)27-21)24-14-16-6-10-19(11-7-16)26-20-12-8-18(9-13-20)17-4-2-1-3-5-17/h6-13,17,21,26H,1-5,14-15H2,(H,24,28)(H2,25,27,29).
What are the key properties of N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide?
N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide has a molecular weight of 392.50 g/mol, XLogP of 3.78, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-cyclohexylanilino)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide is sourced from PubChem (CID 166062569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).