2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine

C11H17N5 — CID 79820779

IUPAC2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESNCCCCCc1nc2nc(N)ccc2[nH]1
InChIInChI=1S/C11H17N5/c12-7-3-1-2-4-10-14-8-5-6-9(13)15-11(8)16-10/h5-6H,1-4,7,12H2,(H3,13,14,15,16)
InChIKeyZFPHIPBOQRYEEW-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.21
Rot. Bonds5

About 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine

2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79820779) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79820779
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC Name2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESNCCCCCc1nc2nc(N)ccc2[nH]1
InChIInChI=1S/C11H17N5/c12-7-3-1-2-4-10-14-8-5-6-9(13)15-11(8)16-10/h5-6H,1-4,7,12H2,(H3,13,14,15,16)
InChIKeyZFPHIPBOQRYEEW-UHFFFAOYSA-N
XLogP1.21
TPSA93.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine (CID 79820779) is 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine is NCCCCCc1nc2nc(N)ccc2[nH]1.
What is the InChIKey of 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is ZFPHIPBOQRYEEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c12-7-3-1-2-4-10-14-8-5-6-9(13)15-11(8)16-10/h5-6H,1-4,7,12H2,(H3,13,14,15,16).
What are the key properties of 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine?
2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 219.29 g/mol, XLogP of 1.21, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79820779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).