N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine

C8H14N4S — CID 65280282

IUPACN-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine
SMILESCN(CCNC1CC1)c1ncns1
InChIInChI=1S/C8H14N4S/c1-12(8-10-6-11-13-8)5-4-9-7-2-3-7/h6-7,9H,2-5H2,1H3
InChIKeyQMYPNABGYZHARP-UHFFFAOYSA-N
MW198.29 g/mol
LogP0.73
Rot. Bonds5

About N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine

N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine (PubChem CID 65280282) has the molecular formula C8H14N4S and a molecular weight of 198.29 g/mol. Its IUPAC name is N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine
PubChem CID65280282
Molecular FormulaC8H14N4S
Molecular Weight198.29 g/mol
Exact Mass198.09
IUPAC NameN-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine
SMILESCN(CCNC1CC1)c1ncns1
InChIInChI=1S/C8H14N4S/c1-12(8-10-6-11-13-8)5-4-9-7-2-3-7/h6-7,9H,2-5H2,1H3
InChIKeyQMYPNABGYZHARP-UHFFFAOYSA-N
XLogP0.73
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-N'-methyl-N'-(5-methylpyrimidin-2-yl)ethane-1,2-diamine
CID 63206209
N-cyclopropyl-N'-methyl-N'-thieno[2,3-d]pyrimidin-4-ylethane-1,2-diamine
CID 62587122
N-cyclopropyl-N'-methyl-N'-(2,3,4-trimethylphenyl)ethane-1,2-diamine
CID 115206920
N-cyclopropyl-N'-methyl-N'-(2-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 62770071
N-[[4-(aminomethyl)phenyl]methyl]-N-methyl-1,2,4-thiadiazol-5-amine
CID 65270237
N-cyclopropyl-N'-methyl-N'-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
CID 62588189
N-cycloheptyl-N'-(3,5-dimethylphenyl)-N'-methylethane-1,2-diamine
CID 63504270
N-cyclopropyl-N'-methyl-N'-(1H-pyrrol-3-yl)ethane-1,2-diamine
CID 115206869
N-cyclopropyl-N'-methyl-N'-(4-propan-2-yloxypyrimidin-2-yl)ethane-1,2-diamine
CID 112639126
N-cyclopropyl-N'-(3,4-difluorophenyl)-N'-methylethane-1,2-diamine
CID 115206849
N-cyclopropyl-N'-methyl-N'-(4-propylphenyl)ethane-1,2-diamine
CID 115206831
N-cyclopropyl-N'-methyl-N'-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)ethane-1,2-diamine
CID 113446593

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine (CID 65280282) is N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine is CN(CCNC1CC1)c1ncns1.
What is the InChIKey of N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine?
The InChIKey is QMYPNABGYZHARP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4S/c1-12(8-10-6-11-13-8)5-4-9-7-2-3-7/h6-7,9H,2-5H2,1H3.
What are the key properties of N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine?
N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine has a molecular weight of 198.29 g/mol, XLogP of 0.73, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-methyl-N'-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine is sourced from PubChem (CID 65280282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).