N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine

C12H18N4O — CID 65483261

IUPACN-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine
SMILESCCNCC(C)c1nc2nc(OC)ccc2[nH]1
InChIInChI=1S/C12H18N4O/c1-4-13-7-8(2)11-14-9-5-6-10(17-3)15-12(9)16-11/h5-6,8,13H,4,7H2,1-3H3,(H,14,15,16)
InChIKeyCXZHBHHNKFKRMM-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.68
Rot. Bonds5

About N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine

N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine (PubChem CID 65483261) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine
PubChem CID65483261
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC NameN-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine
SMILESCCNCC(C)c1nc2nc(OC)ccc2[nH]1
InChIInChI=1S/C12H18N4O/c1-4-13-7-8(2)11-14-9-5-6-10(17-3)15-12(9)16-11/h5-6,8,13H,4,7H2,1-3H3,(H,14,15,16)
InChIKeyCXZHBHHNKFKRMM-UHFFFAOYSA-N
XLogP1.68
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine?
The IUPAC name of N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine (CID 65483261) is N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine?
The canonical SMILES for N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine is CCNCC(C)c1nc2nc(OC)ccc2[nH]1.
What is the InChIKey of N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine?
The InChIKey is CXZHBHHNKFKRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-4-13-7-8(2)11-14-9-5-6-10(17-3)15-12(9)16-11/h5-6,8,13H,4,7H2,1-3H3,(H,14,15,16).
What are the key properties of N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine?
N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine has a molecular weight of 234.30 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine is sourced from PubChem (CID 65483261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).