3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol

C11H17N5O — CID 107835445

IUPAC3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESCN(C)c1ccc2[nH]c(C(O)CCN)nc2n1
InChIInChI=1S/C11H17N5O/c1-16(2)9-4-3-7-10(14-9)15-11(13-7)8(17)5-6-12/h3-4,8,17H,5-6,12H2,1-2H3,(H,13,14,15)
InChIKeyWQKPVRGDYPOULF-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.41
Rot. Bonds4

About 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol

3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol (PubChem CID 107835445) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol
PubChem CID107835445
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESCN(C)c1ccc2[nH]c(C(O)CCN)nc2n1
InChIInChI=1S/C11H17N5O/c1-16(2)9-4-3-7-10(14-9)15-11(13-7)8(17)5-6-12/h3-4,8,17H,5-6,12H2,1-2H3,(H,13,14,15)
InChIKeyWQKPVRGDYPOULF-UHFFFAOYSA-N
XLogP0.41
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The IUPAC name of 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol (CID 107835445) is 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol.
What is the SMILES notation for 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The canonical SMILES for 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol is CN(C)c1ccc2[nH]c(C(O)CCN)nc2n1.
What is the InChIKey of 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The InChIKey is WQKPVRGDYPOULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-16(2)9-4-3-7-10(14-9)15-11(13-7)8(17)5-6-12/h3-4,8,17H,5-6,12H2,1-2H3,(H,13,14,15).
What are the key properties of 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol has a molecular weight of 235.29 g/mol, XLogP of 0.41, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-ol is sourced from PubChem (CID 107835445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).