N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide

C26H24N4O2 — CID 59386736

IUPACN-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide
SMILESNC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1cccc(NC(=O)C2CC2)c1
InChIInChI=1S/C26H24N4O2/c27-25-29-26(20-9-3-1-4-10-20,21-11-5-2-6-12-21)24(32)30(25)17-18-8-7-13-22(16-18)28-23(31)19-14-15-19/h1-13,16,19H,14-15,17H2,(H2,27,29)(H,28,31)
InChIKeyWERUGIZCQNJSEA-UHFFFAOYSA-N
MW424.50 g/mol
LogP3.64
Rot. Bonds6

About N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide

N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide (PubChem CID 59386736) has the molecular formula C26H24N4O2 and a molecular weight of 424.50 g/mol. Its IUPAC name is N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide
PubChem CID59386736
Molecular FormulaC26H24N4O2
Molecular Weight424.50 g/mol
Exact Mass424.19
IUPAC NameN-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide
SMILESNC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1cccc(NC(=O)C2CC2)c1
InChIInChI=1S/C26H24N4O2/c27-25-29-26(20-9-3-1-4-10-20,21-11-5-2-6-12-21)24(32)30(25)17-18-8-7-13-22(16-18)28-23(31)19-14-15-19/h1-13,16,19H,14-15,17H2,(H2,27,29)(H,28,31)
InChIKeyWERUGIZCQNJSEA-UHFFFAOYSA-N
XLogP3.64
TPSA87.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.50
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-[[3-[amino(cyclopropylidene)methyl]phenyl]methyl]-5,5-diphenylimidazol-4-one
CID 89248264
3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(2-methylpropyl)benzamide
CID 59387439
ethyl 1-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]benzoyl]piperidine-3-carboxylate
CID 59387416
4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(3-chlorophenyl)piperidine-1-carboxamide
CID 59387080
3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(2-pyridin-3-ylethyl)benzamide
CID 59388257
N-[3-(aminomethyl)phenyl]cyclopropanecarboxamide;hydrochloride
CID 155822223
2-amino-3-[[4-(oxocan-4-yl)phenyl]methyl]-5,5-diphenylimidazol-4-one
CID 145461543
N-[3-(chloromethyl)phenyl]cyclopropanecarboxamide
CID 114293194
N-[3-[(3,3-diphenylpropanoylamino)methyl]phenyl]cyclopropanecarboxamide
CID 29303854
N-[4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]-3-fluorobenzenesulfonamide
CID 59388804
3-benzyl-N-[3-(cyclopropanecarbonylamino)phenyl]-4-oxophthalazine-1-carboxamide
CID 46570301
(5R)-2-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]anilino]-5-(2-cyclohexylethyl)-5-[[(1S,3S)-3-[(3S)-3-hydroxypyrrolidin-1-yl]cyclohexyl]methyl]-3-methylimidazol-4-one
CID 121300202

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide (CID 59386736) is N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide is NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1cccc(NC(=O)C2CC2)c1.
What is the InChIKey of N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide?
The InChIKey is WERUGIZCQNJSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O2/c27-25-29-26(20-9-3-1-4-10-20,21-11-5-2-6-12-21)24(32)30(25)17-18-8-7-13-22(16-18)28-23(31)19-14-15-19/h1-13,16,19H,14-15,17H2,(H2,27,29)(H,28,31).
What are the key properties of N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide?
N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide has a molecular weight of 424.50 g/mol, XLogP of 3.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 59386736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).