N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide

C20H24N4O — CID 53143748

IUPACN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide
SMILESCCC(C(=O)NCCc1nc2cccnc2n1CC)c1ccccc1
InChIInChI=1S/C20H24N4O/c1-3-16(15-9-6-5-7-10-15)20(25)22-14-12-18-23-17-11-8-13-21-19(17)24(18)4-2/h5-11,13,16H,3-4,12,14H2,1-2H3,(H,22,25)
InChIKeyMJEUNHCANCJATI-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.30
Rot. Bonds7

About N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide

N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide (PubChem CID 53143748) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide.

Molecular Properties

Compound NameN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide
PubChem CID53143748
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC NameN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide
SMILESCCC(C(=O)NCCc1nc2cccnc2n1CC)c1ccccc1
InChIInChI=1S/C20H24N4O/c1-3-16(15-9-6-5-7-10-15)20(25)22-14-12-18-23-17-11-8-13-21-19(17)24(18)4-2/h5-11,13,16H,3-4,12,14H2,1-2H3,(H,22,25)
InChIKeyMJEUNHCANCJATI-UHFFFAOYSA-N
XLogP3.30
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-1-phenylpropan-1-amine
CID 63757298
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide
CID 53143755
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-3-fluorobenzamide
CID 71842734
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide
CID 53143754
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]cyclopropanamine
CID 63758859
2-methoxy-N-[2-(3-propylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide
CID 71842723
2-butyl-3-ethylimidazo[4,5-b]pyridine
CID 150562237
3-amino-N-[2-(1-ethylbenzimidazol-2-yl)ethyl]-2-methyl-3-phenylpropanamide
CID 119866298
2-methoxy-N-[2-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]ethyl]benzamide
CID 50843507
2,4-dimethyl-N-[2-(3-propylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide
CID 71842715
N-[2-(4-hydroxyphenyl)ethyl]-2-phenylbutanamide
CID 61018971
N-[(3-benzylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methylpropanamide
CID 53020555

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide?
The IUPAC name of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide (CID 53143748) is N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide.
What is the SMILES notation for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide?
The canonical SMILES for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide is CCC(C(=O)NCCc1nc2cccnc2n1CC)c1ccccc1.
What is the InChIKey of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide?
The InChIKey is MJEUNHCANCJATI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-3-16(15-9-6-5-7-10-15)20(25)22-14-12-18-23-17-11-8-13-21-19(17)24(18)4-2/h5-11,13,16H,3-4,12,14H2,1-2H3,(H,22,25).
What are the key properties of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide?
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide has a molecular weight of 336.44 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide is sourced from PubChem (CID 53143748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).