3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine

C15H25N5 — CID 81135434

IUPAC3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine
SMILESCc1ccc2nc(N)n(C(CC(C)C)CN(C)C)c2n1
InChIInChI=1S/C15H25N5/c1-10(2)8-12(9-19(4)5)20-14-13(18-15(20)16)7-6-11(3)17-14/h6-7,10,12H,8-9H2,1-5H3,(H2,16,18)
InChIKeyRSHARTAMPBDCHW-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.47
Rot. Bonds5

About 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine

3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine (PubChem CID 81135434) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine
PubChem CID81135434
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine
SMILESCc1ccc2nc(N)n(C(CC(C)C)CN(C)C)c2n1
InChIInChI=1S/C15H25N5/c1-10(2)8-12(9-19(4)5)20-14-13(18-15(20)16)7-6-11(3)17-14/h6-7,10,12H,8-9H2,1-5H3,(H2,16,18)
InChIKeyRSHARTAMPBDCHW-UHFFFAOYSA-N
XLogP2.47
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine (CID 81135434) is 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine is Cc1ccc2nc(N)n(C(CC(C)C)CN(C)C)c2n1.
What is the InChIKey of 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine?
The InChIKey is RSHARTAMPBDCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-10(2)8-12(9-19(4)5)20-14-13(18-15(20)16)7-6-11(3)17-14/h6-7,10,12H,8-9H2,1-5H3,(H2,16,18).
What are the key properties of 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine?
3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine has a molecular weight of 275.40 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(dimethylamino)-4-methylpentan-2-yl]-5-methylimidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 81135434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).