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

C12H18N4 — CID 81137434

IUPACN-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine
SMILESCCNC(C)Cc1nc2nc(C)ccc2[nH]1
InChIInChI=1S/C12H18N4/c1-4-13-9(3)7-11-15-10-6-5-8(2)14-12(10)16-11/h5-6,9,13H,4,7H2,1-3H3,(H,14,15,16)
InChIKeyCKHXDPCKTBVFLJ-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.81
Rot. Bonds4

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

N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine (PubChem CID 81137434) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine
PubChem CID81137434
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC NameN-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine
SMILESCCNC(C)Cc1nc2nc(C)ccc2[nH]1
InChIInChI=1S/C12H18N4/c1-4-13-9(3)7-11-15-10-6-5-8(2)14-12(10)16-11/h5-6,9,13H,4,7H2,1-3H3,(H,14,15,16)
InChIKeyCKHXDPCKTBVFLJ-UHFFFAOYSA-N
XLogP1.81
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine?
The IUPAC name of N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine (CID 81137434) is N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine.
What is the SMILES notation for N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine?
The canonical SMILES for N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine is CCNC(C)Cc1nc2nc(C)ccc2[nH]1.
What is the InChIKey of N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine?
The InChIKey is CKHXDPCKTBVFLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-4-13-9(3)7-11-15-10-6-5-8(2)14-12(10)16-11/h5-6,9,13H,4,7H2,1-3H3,(H,14,15,16).
What are the key properties of N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine?
N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine has a molecular weight of 218.30 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine is sourced from PubChem (CID 81137434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).