4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide

C25H25N3O2 — CID 42693948

IUPAC4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide
SMILESCCCCc1ccc(C(=O)Nc2c(-c3ccc(OC)cc3)nc3ccccn23)cc1
InChIInChI=1S/C25H25N3O2/c1-3-4-7-18-9-11-20(12-10-18)25(29)27-24-23(19-13-15-21(30-2)16-14-19)26-22-8-5-6-17-28(22)24/h5-6,8-17H,3-4,7H2,1-2H3,(H,27,29)
InChIKeyPQIVSGXJFPPAHX-UHFFFAOYSA-N
MW399.49 g/mol
LogP5.60
Rot. Bonds7

About 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide

4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide (PubChem CID 42693948) has the molecular formula C25H25N3O2 and a molecular weight of 399.49 g/mol. Its IUPAC name is 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide.

Molecular Properties

Compound Name4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide
PubChem CID42693948
Molecular FormulaC25H25N3O2
Molecular Weight399.49 g/mol
Exact Mass399.19
IUPAC Name4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide
SMILESCCCCc1ccc(C(=O)Nc2c(-c3ccc(OC)cc3)nc3ccccn23)cc1
InChIInChI=1S/C25H25N3O2/c1-3-4-7-18-9-11-20(12-10-18)25(29)27-24-23(19-13-15-21(30-2)16-14-19)26-22-8-5-6-17-28(22)24/h5-6,8-17H,3-4,7H2,1-2H3,(H,27,29)
InChIKeyPQIVSGXJFPPAHX-UHFFFAOYSA-N
XLogP5.60
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.49
LogP ≤ 55.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dichloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide
CID 42693942
N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-4-ethylbenzamide
CID 42881568
N-[2-(3,4-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]-4-ethylbenzamide
CID 42694678
(2R)-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenylbutanamide
CID 93016839
2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 42693936
N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenylsulfanylacetamide
CID 42693934
N-[2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]pentanamide
CID 42694061
3,4,5-trimethoxy-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 3378236
N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pentanamide
CID 3828486
4-chloro-N-(2-naphthalen-2-ylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 3452000
4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyridin-2-yl]phenol
CID 858017
4-fluoro-N-[2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]benzamide
CID 42694194

Frequently Asked Questions

What is the IUPAC name of 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide?
The IUPAC name of 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide (CID 42693948) is 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide.
What is the SMILES notation for 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide?
The canonical SMILES for 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide is CCCCc1ccc(C(=O)Nc2c(-c3ccc(OC)cc3)nc3ccccn23)cc1.
What is the InChIKey of 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide?
The InChIKey is PQIVSGXJFPPAHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O2/c1-3-4-7-18-9-11-20(12-10-18)25(29)27-24-23(19-13-15-21(30-2)16-14-19)26-22-8-5-6-17-28(22)24/h5-6,8-17H,3-4,7H2,1-2H3,(H,27,29).
What are the key properties of 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide?
4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide has a molecular weight of 399.49 g/mol, XLogP of 5.60, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide is sourced from PubChem (CID 42693948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).