N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide

C15H26N4OS — CID 75519593

IUPACN,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide
SMILESCCN(CC)C(=O)CCC1CCN(c2nnc(C)s2)CC1
InChIInChI=1S/C15H26N4OS/c1-4-18(5-2)14(20)7-6-13-8-10-19(11-9-13)15-17-16-12(3)21-15/h13H,4-11H2,1-3H3
InChIKeyDCYSYXMPYWDDKO-UHFFFAOYSA-N
MW310.47 g/mol
LogP2.71
Rot. Bonds6

About N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide

N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide (PubChem CID 75519593) has the molecular formula C15H26N4OS and a molecular weight of 310.47 g/mol. Its IUPAC name is N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide
PubChem CID75519593
Molecular FormulaC15H26N4OS
Molecular Weight310.47 g/mol
Exact Mass310.18
IUPAC NameN,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide
SMILESCCN(CC)C(=O)CCC1CCN(c2nnc(C)s2)CC1
InChIInChI=1S/C15H26N4OS/c1-4-18(5-2)14(20)7-6-13-8-10-19(11-9-13)15-17-16-12(3)21-15/h13H,4-11H2,1-3H3
InChIKeyDCYSYXMPYWDDKO-UHFFFAOYSA-N
XLogP2.71
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide?
The IUPAC name of N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide (CID 75519593) is N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide.
What is the SMILES notation for N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide?
The canonical SMILES for N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide is CCN(CC)C(=O)CCC1CCN(c2nnc(C)s2)CC1.
What is the InChIKey of N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide?
The InChIKey is DCYSYXMPYWDDKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4OS/c1-4-18(5-2)14(20)7-6-13-8-10-19(11-9-13)15-17-16-12(3)21-15/h13H,4-11H2,1-3H3.
What are the key properties of N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide?
N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide has a molecular weight of 310.47 g/mol, XLogP of 2.71, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]propanamide is sourced from PubChem (CID 75519593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).