N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine

C10H10N4O2 — CID 11672977

IUPACN-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine
SMILESO=[N+]([O-])c1c(NC2CC2)nc2ccccn12
InChIInChI=1S/C10H10N4O2/c15-14(16)10-9(11-7-4-5-7)12-8-3-1-2-6-13(8)10/h1-3,6-7,11H,4-5H2
InChIKeyBYZFYHWAADQRSX-UHFFFAOYSA-N
MW218.22 g/mol
LogP1.82
Rot. Bonds3

About N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine

N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine (PubChem CID 11672977) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine
PubChem CID11672977
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC NameN-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine
SMILESO=[N+]([O-])c1c(NC2CC2)nc2ccccn12
InChIInChI=1S/C10H10N4O2/c15-14(16)10-9(11-7-4-5-7)12-8-3-1-2-6-13(8)10/h1-3,6-7,11H,4-5H2
InChIKeyBYZFYHWAADQRSX-UHFFFAOYSA-N
XLogP1.82
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine?
The IUPAC name of N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine (CID 11672977) is N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine is O=[N+]([O-])c1c(NC2CC2)nc2ccccn12.
What is the InChIKey of N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine?
The InChIKey is BYZFYHWAADQRSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c15-14(16)10-9(11-7-4-5-7)12-8-3-1-2-6-13(8)10/h1-3,6-7,11H,4-5H2.
What are the key properties of N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine?
N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine has a molecular weight of 218.22 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-nitroimidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 11672977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).