2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine

C17H24N4O2S — CID 130283360

IUPAC2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCCc1nc2ccc(C3=CCN(S(C)(=O)=O)CC3)cn2c1N(C)C
InChIInChI=1S/C17H24N4O2S/c1-5-15-17(19(2)3)21-12-14(6-7-16(21)18-15)13-8-10-20(11-9-13)24(4,22)23/h6-8,12H,5,9-11H2,1-4H3
InChIKeySAYHVQHKJZMIHV-UHFFFAOYSA-N
MW348.47 g/mol
LogP2.01
Rot. Bonds4

About 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine

2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 130283360) has the molecular formula C17H24N4O2S and a molecular weight of 348.47 g/mol. Its IUPAC name is 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine
PubChem CID130283360
Molecular FormulaC17H24N4O2S
Molecular Weight348.47 g/mol
Exact Mass348.16
IUPAC Name2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCCc1nc2ccc(C3=CCN(S(C)(=O)=O)CC3)cn2c1N(C)C
InChIInChI=1S/C17H24N4O2S/c1-5-15-17(19(2)3)21-12-14(6-7-16(21)18-15)13-8-10-20(11-9-13)24(4,22)23/h6-8,12H,5,9-11H2,1-4H3
InChIKeySAYHVQHKJZMIHV-UHFFFAOYSA-N
XLogP2.01
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.47
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine (CID 130283360) is 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine is CCc1nc2ccc(C3=CCN(S(C)(=O)=O)CC3)cn2c1N(C)C.
What is the InChIKey of 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is SAYHVQHKJZMIHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2S/c1-5-15-17(19(2)3)21-12-14(6-7-16(21)18-15)13-8-10-20(11-9-13)24(4,22)23/h6-8,12H,5,9-11H2,1-4H3.
What are the key properties of 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine?
2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 348.47 g/mol, XLogP of 2.01, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,N-dimethyl-6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 130283360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).