4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide

C22H28N4O3S — CID 165427050

IUPAC4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide
SMILESCCOc1ccn2cc(C3(c4ccccc4)CCN(S(=O)(=O)N(C)C)CC3)nc2c1
InChIInChI=1S/C22H28N4O3S/c1-4-29-19-10-13-25-17-20(23-21(25)16-19)22(18-8-6-5-7-9-18)11-14-26(15-12-22)30(27,28)24(2)3/h5-10,13,16-17H,4,11-12,14-15H2,1-3H3
InChIKeyRBJPWOYOVIHFRG-UHFFFAOYSA-N
MW428.56 g/mol
LogP2.92
Rot. Bonds6

About 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide

4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide (PubChem CID 165427050) has the molecular formula C22H28N4O3S and a molecular weight of 428.56 g/mol. Its IUPAC name is 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide
PubChem CID165427050
Molecular FormulaC22H28N4O3S
Molecular Weight428.56 g/mol
Exact Mass428.19
IUPAC Name4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide
SMILESCCOc1ccn2cc(C3(c4ccccc4)CCN(S(=O)(=O)N(C)C)CC3)nc2c1
InChIInChI=1S/C22H28N4O3S/c1-4-29-19-10-13-25-17-20(23-21(25)16-19)22(18-8-6-5-7-9-18)11-14-26(15-12-22)30(27,28)24(2)3/h5-10,13,16-17H,4,11-12,14-15H2,1-3H3
InChIKeyRBJPWOYOVIHFRG-UHFFFAOYSA-N
XLogP2.92
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.56
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide?
The IUPAC name of 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide (CID 165427050) is 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide.
What is the SMILES notation for 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide?
The canonical SMILES for 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide is CCOc1ccn2cc(C3(c4ccccc4)CCN(S(=O)(=O)N(C)C)CC3)nc2c1.
What is the InChIKey of 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide?
The InChIKey is RBJPWOYOVIHFRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O3S/c1-4-29-19-10-13-25-17-20(23-21(25)16-19)22(18-8-6-5-7-9-18)11-14-26(15-12-22)30(27,28)24(2)3/h5-10,13,16-17H,4,11-12,14-15H2,1-3H3.
What are the key properties of 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide?
4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide has a molecular weight of 428.56 g/mol, XLogP of 2.92, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-ethoxyimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl-4-phenylpiperidine-1-sulfonamide is sourced from PubChem (CID 165427050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).