1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea

C24H25N5O3 — CID 42626338

IUPAC1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea
SMILESCn1c(=O)[nH]c2nccc(Oc3ccc(NC(=O)Nc4cccc(C(C)(C)C)c4)cc3)c21
InChIInChI=1S/C24H25N5O3/c1-24(2,3)15-6-5-7-17(14-15)27-22(30)26-16-8-10-18(11-9-16)32-19-12-13-25-21-20(19)29(4)23(31)28-21/h5-14H,1-4H3,(H,25,28,31)(H2,26,27,30)
InChIKeyJGNQOPPOBDRBEQ-UHFFFAOYSA-N
MW431.50 g/mol
LogP5.00
Rot. Bonds4

About 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea

1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea (PubChem CID 42626338) has the molecular formula C24H25N5O3 and a molecular weight of 431.50 g/mol. Its IUPAC name is 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea.

Molecular Properties

Compound Name1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea
PubChem CID42626338
Molecular FormulaC24H25N5O3
Molecular Weight431.50 g/mol
Exact Mass431.20
IUPAC Name1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea
SMILESCn1c(=O)[nH]c2nccc(Oc3ccc(NC(=O)Nc4cccc(C(C)(C)C)c4)cc3)c21
InChIInChI=1S/C24H25N5O3/c1-24(2,3)15-6-5-7-17(14-15)27-22(30)26-16-8-10-18(11-9-16)32-19-12-13-25-21-20(19)29(4)23(31)28-21/h5-14H,1-4H3,(H,25,28,31)(H2,26,27,30)
InChIKeyJGNQOPPOBDRBEQ-UHFFFAOYSA-N
XLogP5.00
TPSA101.04 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.50
LogP ≤ 55.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Imidazopyridine-urea,42
CID 10117977
1-(2-(2-Tert-butylphenoxy)pyridin-3-yl)-3-(4-(trifluoromethoxy)phenyl)urea
CID 11510579
V600Ebraf-IN-1
CID 11719900
Pyridoimidazolone, 26
CID 42625162
Urea, N-[4-chloro-3-(trifluoromethyl)phenyl]-N'-[4-[(2,3-dihydro-2-oxo-1H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]-
CID 42625505
Pyridoimidazolone, 5d
CID 42626192
Pyridoimidazolone, 5e
CID 42626193
Pyridoimidazolone, 5h
CID 42626196
Urea, N-[4-[(2,3-dihydro-2-oxo-1H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]-N'-[2-methoxy-5-(trifluoromethyl)phenyl]-
CID 42626197
Pyridoimidazolone, 5j
CID 42626265
Pyridoimidazolone, 5m
CID 42626268
Pyridoimidazolone, 5o
CID 42626270

Frequently Asked Questions

What is the IUPAC name of 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea?
The IUPAC name of 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea (CID 42626338) is 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea.
What is the SMILES notation for 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea?
The canonical SMILES for 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea is Cn1c(=O)[nH]c2nccc(Oc3ccc(NC(=O)Nc4cccc(C(C)(C)C)c4)cc3)c21.
What is the InChIKey of 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea?
The InChIKey is JGNQOPPOBDRBEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O3/c1-24(2,3)15-6-5-7-17(14-15)27-22(30)26-16-8-10-18(11-9-16)32-19-12-13-25-21-20(19)29(4)23(31)28-21/h5-14H,1-4H3,(H,25,28,31)(H2,26,27,30).
What are the key properties of 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea?
1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea has a molecular weight of 431.50 g/mol, XLogP of 5.00, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-tert-butylphenyl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea is sourced from PubChem (CID 42626338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).