N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide

C16H21N3OS — CID 136522053

IUPACN,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide
SMILESCN(C)C(=O)CC1CCN(c2ccnc3ccsc23)CC1
InChIInChI=1S/C16H21N3OS/c1-18(2)15(20)11-12-4-8-19(9-5-12)14-3-7-17-13-6-10-21-16(13)14/h3,6-7,10,12H,4-5,8-9,11H2,1-2H3
InChIKeyYWAZCZVLYYMHFV-UHFFFAOYSA-N
MW303.43 g/mol
LogP2.99
Rot. Bonds3

About N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide

N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide (PubChem CID 136522053) has the molecular formula C16H21N3OS and a molecular weight of 303.43 g/mol. Its IUPAC name is N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide
PubChem CID136522053
Molecular FormulaC16H21N3OS
Molecular Weight303.43 g/mol
Exact Mass303.14
IUPAC NameN,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide
SMILESCN(C)C(=O)CC1CCN(c2ccnc3ccsc23)CC1
InChIInChI=1S/C16H21N3OS/c1-18(2)15(20)11-12-4-8-19(9-5-12)14-3-7-17-13-6-10-21-16(13)14/h3,6-7,10,12H,4-5,8-9,11H2,1-2H3
InChIKeyYWAZCZVLYYMHFV-UHFFFAOYSA-N
XLogP2.99
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide (CID 136522053) is N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide is CN(C)C(=O)CC1CCN(c2ccnc3ccsc23)CC1.
What is the InChIKey of N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide?
The InChIKey is YWAZCZVLYYMHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3OS/c1-18(2)15(20)11-12-4-8-19(9-5-12)14-3-7-17-13-6-10-21-16(13)14/h3,6-7,10,12H,4-5,8-9,11H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide?
N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide has a molecular weight of 303.43 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1-thieno[3,2-b]pyridin-7-ylpiperidin-4-yl)acetamide is sourced from PubChem (CID 136522053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).