N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine

C11H18N4S — CID 106641188

IUPACN-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
SMILESc1nsc(N(CC2CCCCN2)C2CC2)n1
InChIInChI=1S/C11H18N4S/c1-2-6-12-9(3-1)7-15(10-4-5-10)11-13-8-14-16-11/h8-10,12H,1-7H2
InChIKeyVXLLEMXBZNATDQ-UHFFFAOYSA-N
MW238.36 g/mol
LogP1.65
Rot. Bonds4

About N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine

N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine (PubChem CID 106641188) has the molecular formula C11H18N4S and a molecular weight of 238.36 g/mol. Its IUPAC name is N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
PubChem CID106641188
Molecular FormulaC11H18N4S
Molecular Weight238.36 g/mol
Exact Mass238.13
IUPAC NameN-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
SMILESc1nsc(N(CC2CCCCN2)C2CC2)n1
InChIInChI=1S/C11H18N4S/c1-2-6-12-9(3-1)7-15(10-4-5-10)11-13-8-14-16-11/h8-10,12H,1-7H2
InChIKeyVXLLEMXBZNATDQ-UHFFFAOYSA-N
XLogP1.65
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine
CID 106642542
N-(2-bromoethyl)-N-cyclobutyl-1,2,4-thiadiazol-5-amine
CID 102871525
N-cyclopropyl-5-nitro-N-(piperidin-2-ylmethyl)-1,3-thiazol-2-amine
CID 106641069
5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
CID 106640995
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 106621078
N-cyclopropyl-N-(piperidin-2-ylmethyl)-2,1-benzothiazol-3-amine
CID 106641159
N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 65276095
N-cyclopropyl-N-(piperidin-2-ylmethyl)quinazolin-4-amine
CID 106640940
N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine
CID 106641172
N-cyclopropyl-N-(piperidin-2-ylmethyl)quinoxalin-2-amine
CID 106641225
N-cyclopropyl-1-ethyl-N-(piperidin-2-ylmethyl)imidazol-2-amine
CID 106640976
N'-cyclohexyl-N'-(1,2,4-thiadiazol-5-yl)propane-1,3-diamine
CID 65270703

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine (CID 106641188) is N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine is c1nsc(N(CC2CCCCN2)C2CC2)n1.
What is the InChIKey of N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine?
The InChIKey is VXLLEMXBZNATDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4S/c1-2-6-12-9(3-1)7-15(10-4-5-10)11-13-8-14-16-11/h8-10,12H,1-7H2.
What are the key properties of N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine?
N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine has a molecular weight of 238.36 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 106641188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).