8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine

C23H33N5S — CID 22024591

IUPAC8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine
SMILESCCCN(CCC)c1c(SC)nc2c(-c3c(C)cc(N(C)C)nc3C)cccn12
InChIInChI=1S/C23H33N5S/c1-8-12-27(13-9-2)23-22(29-7)25-21-18(11-10-14-28(21)23)20-16(3)15-19(26(5)6)24-17(20)4/h10-11,14-15H,8-9,12-13H2,1-7H3
InChIKeyVEOYLLWFCYMQPU-UHFFFAOYSA-N
MW411.62 g/mol
LogP5.43
Rot. Bonds8

About 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine

8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine (PubChem CID 22024591) has the molecular formula C23H33N5S and a molecular weight of 411.62 g/mol. Its IUPAC name is 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine
PubChem CID22024591
Molecular FormulaC23H33N5S
Molecular Weight411.62 g/mol
Exact Mass411.25
IUPAC Name8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine
SMILESCCCN(CCC)c1c(SC)nc2c(-c3c(C)cc(N(C)C)nc3C)cccn12
InChIInChI=1S/C23H33N5S/c1-8-12-27(13-9-2)23-22(29-7)25-21-18(11-10-14-28(21)23)20-16(3)15-19(26(5)6)24-17(20)4/h10-11,14-15H,8-9,12-13H2,1-7H3
InChIKeyVEOYLLWFCYMQPU-UHFFFAOYSA-N
XLogP5.43
TPSA36.67 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.62
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine (CID 22024591) is 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine is CCCN(CCC)c1c(SC)nc2c(-c3c(C)cc(N(C)C)nc3C)cccn12.
What is the InChIKey of 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is VEOYLLWFCYMQPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N5S/c1-8-12-27(13-9-2)23-22(29-7)25-21-18(11-10-14-28(21)23)20-16(3)15-19(26(5)6)24-17(20)4/h10-11,14-15H,8-9,12-13H2,1-7H3.
What are the key properties of 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine?
8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 411.62 g/mol, XLogP of 5.43, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-2-methylsulfanyl-N,N-dipropylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 22024591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).