3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine

C11H17N5O — CID 115322083

IUPAC3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc2nc(N)n(CCN(C)C)c2n1
InChIInChI=1S/C11H17N5O/c1-15(2)6-7-16-10-8(13-11(16)12)4-5-9(14-10)17-3/h4-5H,6-7H2,1-3H3,(H2,12,13)
InChIKeyPXINRRIAURKRRC-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.58
Rot. Bonds4

About 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine

3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine (PubChem CID 115322083) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
PubChem CID115322083
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc2nc(N)n(CCN(C)C)c2n1
InChIInChI=1S/C11H17N5O/c1-15(2)6-7-16-10-8(13-11(16)12)4-5-9(14-10)17-3/h4-5H,6-7H2,1-3H3,(H2,12,13)
InChIKeyPXINRRIAURKRRC-UHFFFAOYSA-N
XLogP0.58
TPSA69.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methoxy-3-(3-methylsulfanylpropyl)imidazo[4,5-b]pyridin-2-amine
CID 115322427
5-methoxy-3-(2-methoxypropyl)imidazo[4,5-b]pyridin-2-amine
CID 102699356
N-[2-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)ethyl]methanesulfonamide
CID 115322213
5-methoxy-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 106105695
3-(cyclohexylmethyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322201
5-methoxy-3-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 115322400
ethyl 4-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)butanoate
CID 115322446
3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322450
3-[2-(1-chloroethyl)-5-methoxyimidazo[4,5-b]pyridin-3-yl]-N,N-dimethylpropan-1-amine
CID 115322579
5-methoxy-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 115322105
5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 115322294
5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 113286867

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine (CID 115322083) is 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine is COc1ccc2nc(N)n(CCN(C)C)c2n1.
What is the InChIKey of 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The InChIKey is PXINRRIAURKRRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-15(2)6-7-16-10-8(13-11(16)12)4-5-9(14-10)17-3/h4-5H,6-7H2,1-3H3,(H2,12,13).
What are the key properties of 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine?
3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine has a molecular weight of 235.29 g/mol, XLogP of 0.58, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 115322083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).