N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide

C31H29N3O — CID 5074475

IUPACN-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide
SMILESO=C(CC(c1ccccc1)c1cnc2ccccn12)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H29N3O/c35-31(32-20-19-27(24-12-4-1-5-13-24)25-14-6-2-7-15-25)22-28(26-16-8-3-9-17-26)29-23-33-30-18-10-11-21-34(29)30/h1-18,21,23,27-28H,19-20,22H2,(H,32,35)
InChIKeyJQUPZZKAZMQKGV-UHFFFAOYSA-N
MW459.59 g/mol
LogP6.19
Rot. Bonds9

About N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide

N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide (PubChem CID 5074475) has the molecular formula C31H29N3O and a molecular weight of 459.59 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide
PubChem CID5074475
Molecular FormulaC31H29N3O
Molecular Weight459.59 g/mol
Exact Mass459.23
IUPAC NameN-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide
SMILESO=C(CC(c1ccccc1)c1cnc2ccccn12)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H29N3O/c35-31(32-20-19-27(24-12-4-1-5-13-24)25-14-6-2-7-15-25)22-28(26-16-8-3-9-17-26)29-23-33-30-18-10-11-21-34(29)30/h1-18,21,23,27-28H,19-20,22H2,(H,32,35)
InChIKeyJQUPZZKAZMQKGV-UHFFFAOYSA-N
XLogP6.19
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500459.59
LogP ≤ 56.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(3S)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanoyl]amino]ethyl-dimethylazanium
CID 7301673
3-imidazo[1,2-a]pyridin-3-yl-3-phenyl-N-(pyridin-4-ylmethyl)propanamide
CID 42782840
N-benzyl-3-imidazo[1,2-a]pyridin-3-yl-3-[3-(trifluoromethyl)phenyl]propanamide
CID 4197390
N-[2-(2,4-dichlorophenyl)ethyl]-3-(3-fluorophenyl)-3-imidazo[1,2-a]pyridin-3-ylpropanamide
CID 4068487
3-imidazo[1,2-a]pyridin-3-yl-3-(2-methoxyphenyl)-N-(2-phenylethyl)propanamide
CID 42782038
1-(4-benzhydrylpiperazin-1-yl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropan-1-one
CID 5058665
N-[3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propyl]-3,3-diphenylpropanamide
CID 60524723
3,3-diphenyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide
CID 9291191
(3S)-N-(3,3-diphenylpropyl)-3-phenylbutanamide
CID 8012205
(3R)-N-(3,3-diphenylpropyl)-3-phenylbutanamide
CID 40629946
N-(3,4-dimethylphenyl)-3-imidazo[1,2-a]pyridin-3-yl-3-[3-(trifluoromethyl)phenyl]propanamide
CID 3418425
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-fluorophenyl)-3-imidazo[1,2-a]pyridin-3-ylpropanamide
CID 42782043

Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide?
The IUPAC name of N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide (CID 5074475) is N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide is O=C(CC(c1ccccc1)c1cnc2ccccn12)NCCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide?
The InChIKey is JQUPZZKAZMQKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H29N3O/c35-31(32-20-19-27(24-12-4-1-5-13-24)25-14-6-2-7-15-25)22-28(26-16-8-3-9-17-26)29-23-33-30-18-10-11-21-34(29)30/h1-18,21,23,27-28H,19-20,22H2,(H,32,35).
What are the key properties of N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide?
N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide has a molecular weight of 459.59 g/mol, XLogP of 6.19, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide is sourced from PubChem (CID 5074475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).