N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide

C10H18N4OS — CID 65271174

IUPACN,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide
SMILESCCCc1nsc(NCCC(=O)N(C)C)n1
InChIInChI=1S/C10H18N4OS/c1-4-5-8-12-10(16-13-8)11-7-6-9(15)14(2)3/h4-7H2,1-3H3,(H,11,12,13)
InChIKeyGMPPESCLGYCQPG-UHFFFAOYSA-N
MW242.35 g/mol
LogP1.38
Rot. Bonds6

About N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide

N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide (PubChem CID 65271174) has the molecular formula C10H18N4OS and a molecular weight of 242.35 g/mol. Its IUPAC name is N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide
PubChem CID65271174
Molecular FormulaC10H18N4OS
Molecular Weight242.35 g/mol
Exact Mass242.12
IUPAC NameN,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide
SMILESCCCc1nsc(NCCC(=O)N(C)C)n1
InChIInChI=1S/C10H18N4OS/c1-4-5-8-12-10(16-13-8)11-7-6-9(15)14(2)3/h4-7H2,1-3H3,(H,11,12,13)
InChIKeyGMPPESCLGYCQPG-UHFFFAOYSA-N
XLogP1.38
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.35
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide?
The IUPAC name of N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide (CID 65271174) is N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide.
What is the SMILES notation for N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide?
The canonical SMILES for N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide is CCCc1nsc(NCCC(=O)N(C)C)n1.
What is the InChIKey of N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide?
The InChIKey is GMPPESCLGYCQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4OS/c1-4-5-8-12-10(16-13-8)11-7-6-9(15)14(2)3/h4-7H2,1-3H3,(H,11,12,13).
What are the key properties of N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide?
N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide has a molecular weight of 242.35 g/mol, XLogP of 1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]propanamide is sourced from PubChem (CID 65271174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).