N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide

C17H24N4O — CID 16674902

IUPACN-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide
SMILESCCn1c(C(CC(C)C)NC(=O)C2CC2)nc2cccnc21
InChIInChI=1S/C17H24N4O/c1-4-21-15-13(6-5-9-18-15)19-16(21)14(10-11(2)3)20-17(22)12-7-8-12/h5-6,9,11-12,14H,4,7-8,10H2,1-3H3,(H,20,22)
InChIKeyWCXWLXBIYYAOJB-UHFFFAOYSA-N
MW300.41 g/mol
LogP3.06
Rot. Bonds6

About N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide

N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide (PubChem CID 16674902) has the molecular formula C17H24N4O and a molecular weight of 300.41 g/mol. Its IUPAC name is N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide
PubChem CID16674902
Molecular FormulaC17H24N4O
Molecular Weight300.41 g/mol
Exact Mass300.20
IUPAC NameN-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide
SMILESCCn1c(C(CC(C)C)NC(=O)C2CC2)nc2cccnc21
InChIInChI=1S/C17H24N4O/c1-4-21-15-13(6-5-9-18-15)19-16(21)14(10-11(2)3)20-17(22)12-7-8-12/h5-6,9,11-12,14H,4,7-8,10H2,1-3H3,(H,20,22)
InChIKeyWCXWLXBIYYAOJB-UHFFFAOYSA-N
XLogP3.06
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide?
The IUPAC name of N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide (CID 16674902) is N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide?
The canonical SMILES for N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide is CCn1c(C(CC(C)C)NC(=O)C2CC2)nc2cccnc21.
What is the InChIKey of N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide?
The InChIKey is WCXWLXBIYYAOJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O/c1-4-21-15-13(6-5-9-18-15)19-16(21)14(10-11(2)3)20-17(22)12-7-8-12/h5-6,9,11-12,14H,4,7-8,10H2,1-3H3,(H,20,22).
What are the key properties of N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide?
N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide has a molecular weight of 300.41 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide is sourced from PubChem (CID 16674902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).