N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide

C27H23N5O4 — CID 35338889

IUPACN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
SMILESO=C(NCc1ccco1)Nc1ccc(NC(=O)c2cccc(OCc3cn4ccccc4n3)c2)cc1
InChIInChI=1S/C27H23N5O4/c33-26(30-20-9-11-21(12-10-20)31-27(34)28-16-24-7-4-14-35-24)19-5-3-6-23(15-19)36-18-22-17-32-13-2-1-8-25(32)29-22/h1-15,17H,16,18H2,(H,30,33)(H2,28,31,34)
InChIKeyMJOUUGOVAYEVAX-UHFFFAOYSA-N
MW481.51 g/mol
LogP5.08
Rot. Bonds8

About N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide

N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide (PubChem CID 35338889) has the molecular formula C27H23N5O4 and a molecular weight of 481.51 g/mol. Its IUPAC name is N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
PubChem CID35338889
Molecular FormulaC27H23N5O4
Molecular Weight481.51 g/mol
Exact Mass481.18
IUPAC NameN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
SMILESO=C(NCc1ccco1)Nc1ccc(NC(=O)c2cccc(OCc3cn4ccccc4n3)c2)cc1
InChIInChI=1S/C27H23N5O4/c33-26(30-20-9-11-21(12-10-20)31-27(34)28-16-24-7-4-14-35-24)19-5-3-6-23(15-19)36-18-22-17-32-13-2-1-8-25(32)29-22/h1-15,17H,16,18H2,(H,30,33)(H2,28,31,34)
InChIKeyMJOUUGOVAYEVAX-UHFFFAOYSA-N
XLogP5.08
TPSA109.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500481.51
LogP ≤ 55.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-ethylphenyl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 24542057
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[4-(methylsulfamoyl)phenyl]benzamide
CID 27711748
methyl 2-[[3-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]benzoyl]amino]acetate
CID 55848603
N-[(2-chlorophenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 24542001
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(2,4,6-trimethylphenyl)benzamide
CID 78829643
3,4-difluoro-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530610
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 49088051
2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide
CID 56530502
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-pentylbenzamide
CID 134009641
N-[(3,5-dimethoxyphenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 55576832
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 7063876
4-[(carbamoylamino)methyl]-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56584450

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide?
The IUPAC name of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide (CID 35338889) is N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide.
What is the SMILES notation for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide?
The canonical SMILES for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide is O=C(NCc1ccco1)Nc1ccc(NC(=O)c2cccc(OCc3cn4ccccc4n3)c2)cc1.
What is the InChIKey of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide?
The InChIKey is MJOUUGOVAYEVAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N5O4/c33-26(30-20-9-11-21(12-10-20)31-27(34)28-16-24-7-4-14-35-24)19-5-3-6-23(15-19)36-18-22-17-32-13-2-1-8-25(32)29-22/h1-15,17H,16,18H2,(H,30,33)(H2,28,31,34).
What are the key properties of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide?
N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide has a molecular weight of 481.51 g/mol, XLogP of 5.08, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide is sourced from PubChem (CID 35338889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).