2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide

C15H26N4OS — CID 125160379

IUPAC2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide
SMILESCc1csc([C@H](C)CNC(=O)CN(C)C2CCNCC2)n1
InChIInChI=1S/C15H26N4OS/c1-11(15-18-12(2)10-21-15)8-17-14(20)9-19(3)13-4-6-16-7-5-13/h10-11,13,16H,4-9H2,1-3H3,(H,17,20)/t11-/m1/s1
InChIKeyAQNHMGOFORBXLE-LLVKDONJSA-N
MW310.47 g/mol
LogP1.36
Rot. Bonds6

About 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide

2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide (PubChem CID 125160379) has the molecular formula C15H26N4OS and a molecular weight of 310.47 g/mol. Its IUPAC name is 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide.

Molecular Properties

Compound Name2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide
PubChem CID125160379
Molecular FormulaC15H26N4OS
Molecular Weight310.47 g/mol
Exact Mass310.18
IUPAC Name2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide
SMILESCc1csc([C@H](C)CNC(=O)CN(C)C2CCNCC2)n1
InChIInChI=1S/C15H26N4OS/c1-11(15-18-12(2)10-21-15)8-17-14(20)9-19(3)13-4-6-16-7-5-13/h10-11,13,16H,4-9H2,1-3H3,(H,17,20)/t11-/m1/s1
InChIKeyAQNHMGOFORBXLE-LLVKDONJSA-N
XLogP1.36
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide?
The IUPAC name of 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide (CID 125160379) is 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide.
What is the SMILES notation for 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide?
The canonical SMILES for 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide is Cc1csc([C@H](C)CNC(=O)CN(C)C2CCNCC2)n1.
What is the InChIKey of 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide?
The InChIKey is AQNHMGOFORBXLE-LLVKDONJSA-N. The full InChI is InChI=1S/C15H26N4OS/c1-11(15-18-12(2)10-21-15)8-17-14(20)9-19(3)13-4-6-16-7-5-13/h10-11,13,16H,4-9H2,1-3H3,(H,17,20)/t11-/m1/s1.
What are the key properties of 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide?
2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide has a molecular weight of 310.47 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(piperidin-4-yl)amino]-N-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide is sourced from PubChem (CID 125160379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).