1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine

C11H16N4O — CID 79295428

IUPAC1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine
SMILESCCOCCCn1c(N)nc2cnccc21
InChIInChI=1S/C11H16N4O/c1-2-16-7-3-6-15-10-4-5-13-8-9(10)14-11(15)12/h4-5,8H,2-3,6-7H2,1H3,(H2,12,14)
InChIKeyMVVNUDWFMKAXLL-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.44
Rot. Bonds5

About 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine

1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine (PubChem CID 79295428) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine
PubChem CID79295428
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine
SMILESCCOCCCn1c(N)nc2cnccc21
InChIInChI=1S/C11H16N4O/c1-2-16-7-3-6-15-10-4-5-13-8-9(10)14-11(15)12/h4-5,8H,2-3,6-7H2,1H3,(H2,12,14)
InChIKeyMVVNUDWFMKAXLL-UHFFFAOYSA-N
XLogP1.44
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine?
The IUPAC name of 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine (CID 79295428) is 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine?
The canonical SMILES for 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine is CCOCCCn1c(N)nc2cnccc21.
What is the InChIKey of 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine?
The InChIKey is MVVNUDWFMKAXLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-2-16-7-3-6-15-10-4-5-13-8-9(10)14-11(15)12/h4-5,8H,2-3,6-7H2,1H3,(H2,12,14).
What are the key properties of 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine?
1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine has a molecular weight of 220.28 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 79295428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).