N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide

C21H21N3O — CID 110436229

IUPACN-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide
SMILESO=C(CCn1cnc(-c2ccccc2)c1-c1ccccc1)NC1CC1
InChIInChI=1S/C21H21N3O/c25-19(23-18-11-12-18)13-14-24-15-22-20(16-7-3-1-4-8-16)21(24)17-9-5-2-6-10-17/h1-10,15,18H,11-14H2,(H,23,25)
InChIKeyBMEJWTHQPFOTHQ-UHFFFAOYSA-N
MW331.42 g/mol
LogP3.89
Rot. Bonds6

About N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide

N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide (PubChem CID 110436229) has the molecular formula C21H21N3O and a molecular weight of 331.42 g/mol. Its IUPAC name is N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide
PubChem CID110436229
Molecular FormulaC21H21N3O
Molecular Weight331.42 g/mol
Exact Mass331.17
IUPAC NameN-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide
SMILESO=C(CCn1cnc(-c2ccccc2)c1-c1ccccc1)NC1CC1
InChIInChI=1S/C21H21N3O/c25-19(23-18-11-12-18)13-14-24-15-22-20(16-7-3-1-4-8-16)21(24)17-9-5-2-6-10-17/h1-10,15,18H,11-14H2,(H,23,25)
InChIKeyBMEJWTHQPFOTHQ-UHFFFAOYSA-N
XLogP3.89
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 50759218
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CID 53033035
N-cyclopentyl-3-(1-methyl-3-phenylpyrazol-4-yl)propanamide
CID 53033030
N-(1-benzylpiperidin-4-yl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 25392161
N-cyclopropyl-3-(4,5-dichloro-6-oxopyrimidin-1-yl)propanamide
CID 114583075
4,5-diphenyl-1-propylimidazole
CID 14950648
7-(4,5-diphenylimidazol-1-yl)-1-phenylheptan-2-one
CID 10179650
N-cyclopropyl-N'-phenylbutanediamide
CID 70314355
3-(4,5-diphenylimidazol-1-yl)-N-[(E)-1H-indol-3-ylmethylideneamino]propanamide
CID 135641994
3-[4-phenyl-5-[4-(1,2,4-triazol-1-yl)phenyl]imidazol-1-yl]propanamide
CID 56868549
3-(4,5-diphenylimidazol-1-yl)-N-[(Z)-(3-methoxyphenyl)methylideneamino]propanamide
CID 35583303
1-[3-(cyclopropylamino)-3-oxopropyl]-2-oxopyridine-3-carboxylic acid
CID 55098640

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide?
The IUPAC name of N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide (CID 110436229) is N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide is O=C(CCn1cnc(-c2ccccc2)c1-c1ccccc1)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide?
The InChIKey is BMEJWTHQPFOTHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O/c25-19(23-18-11-12-18)13-14-24-15-22-20(16-7-3-1-4-8-16)21(24)17-9-5-2-6-10-17/h1-10,15,18H,11-14H2,(H,23,25).
What are the key properties of N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide?
N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide has a molecular weight of 331.42 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide is sourced from PubChem (CID 110436229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).