N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine

C11H20N4S — CID 65270703

IUPACN'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine
SMILESNCCCN(c1ncns1)C1CCCCC1
InChIInChI=1S/C11H20N4S/c12-7-4-8-15(11-13-9-14-16-11)10-5-2-1-3-6-10/h9-10H,1-8,12H2
InChIKeyNXPORNIVFFFMMW-UHFFFAOYSA-N
MW240.38 g/mol
LogP2.03
Rot. Bonds5

About N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine

N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine (PubChem CID 65270703) has the molecular formula C11H20N4S and a molecular weight of 240.38 g/mol. Its IUPAC name is N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine
PubChem CID65270703
Molecular FormulaC11H20N4S
Molecular Weight240.38 g/mol
Exact Mass240.14
IUPAC NameN'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine
SMILESNCCCN(c1ncns1)C1CCCCC1
InChIInChI=1S/C11H20N4S/c12-7-4-8-15(11-13-9-14-16-11)10-5-2-1-3-6-10/h9-10H,1-8,12H2
InChIKeyNXPORNIVFFFMMW-UHFFFAOYSA-N
XLogP2.03
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.38
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-bromoethyl)-N-cyclobutyl-1,2,4-thiadiazol-5-amine
CID 102871525
N'-cyclohexyl-N'-(5-methyl-1,3,4-thiadiazol-2-yl)propane-1,3-diamine
CID 65209033
N'-(3-tert-butyl-1,2,4-thiadiazol-5-yl)-N'-cyclopentylpropane-1,3-diamine
CID 65270547
3-[cyclopropyl(1,2,4-thiadiazol-5-yl)amino]propanimidamide
CID 65272361
N'-cyclobutyl-N'-(3-methyl-1,2,4-thiadiazol-5-yl)propane-1,3-diamine
CID 102874524
N'-(1,3-benzothiazol-2-yl)-N'-cyclohexylpropane-1,3-diamine
CID 60870636
N'-cyclohexyl-N'-pyridin-4-ylpropane-1,3-diamine
CID 43137168
N'-cyclobutyl-N'-(4-methyl-1,3-thiazol-2-yl)propane-1,3-diamine
CID 102874488
N'-cyclopentyl-N'-(5-iodopyrimidin-2-yl)propane-1,3-diamine
CID 116648233
N'-cycloheptyl-N'-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)propane-1,3-diamine
CID 62833493
N'-cyclohexyl-N'-(1-methylimidazol-2-yl)propane-1,3-diamine
CID 62132183
N'-cycloheptyl-N'-(6-ethoxypyrimidin-4-yl)propane-1,3-diamine
CID 66317669

Frequently Asked Questions

What is the IUPAC name of N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine?
The IUPAC name of N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine (CID 65270703) is N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine.
What is the SMILES notation for N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine?
The canonical SMILES for N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine is NCCCN(c1ncns1)C1CCCCC1.
What is the InChIKey of N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine?
The InChIKey is NXPORNIVFFFMMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4S/c12-7-4-8-15(11-13-9-14-16-11)10-5-2-1-3-6-10/h9-10H,1-8,12H2.
What are the key properties of N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine?
N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine has a molecular weight of 240.38 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine is sourced from PubChem (CID 65270703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).