N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide

C14H24N4OS — CID 106626170

IUPACN-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide
SMILESCCCc1nnsc1C(=O)N(CC)CC1CCCCN1
InChIInChI=1S/C14H24N4OS/c1-3-7-12-13(20-17-16-12)14(19)18(4-2)10-11-8-5-6-9-15-11/h11,15H,3-10H2,1-2H3
InChIKeyQQNNWJBBVIHLBX-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.09
Rot. Bonds6

About N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide

N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide (PubChem CID 106626170) has the molecular formula C14H24N4OS and a molecular weight of 296.44 g/mol. Its IUPAC name is N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide
PubChem CID106626170
Molecular FormulaC14H24N4OS
Molecular Weight296.44 g/mol
Exact Mass296.17
IUPAC NameN-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide
SMILESCCCc1nnsc1C(=O)N(CC)CC1CCCCN1
InChIInChI=1S/C14H24N4OS/c1-3-7-12-13(20-17-16-12)14(19)18(4-2)10-11-8-5-6-9-15-11/h11,15H,3-10H2,1-2H3
InChIKeyQQNNWJBBVIHLBX-UHFFFAOYSA-N
XLogP2.09
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,3-diethyl-1-(piperidin-2-ylmethyl)urea
CID 106629771
N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide
CID 106609110
N,4-diethyl-N-(piperidin-3-ylmethyl)thiadiazole-5-carboxamide
CID 106629440
4-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylthiadiazole-5-carboxamide
CID 106626701
N-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)-1H-1,2,4-triazole-3-carboxamide
CID 106609199
N-ethyl-2,6-difluoro-N-(piperidin-2-ylmethyl)benzamide
CID 106626235
N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide
CID 106626410
N-methyl-N-(piperidin-2-ylmethyl)-4-propan-2-ylthiadiazole-5-carboxamide
CID 106627200
3-bromo-N-ethyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide
CID 106609503
N-cyclopropyl-4-methyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide
CID 106599443
4-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide;hydrochloride
CID 119510567
N-ethyl-N-piperidin-3-yl-4-propylthiadiazole-5-carboxamide
CID 65210392

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide?
The IUPAC name of N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide (CID 106626170) is N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide.
What is the SMILES notation for N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide?
The canonical SMILES for N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide is CCCc1nnsc1C(=O)N(CC)CC1CCCCN1.
What is the InChIKey of N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide?
The InChIKey is QQNNWJBBVIHLBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4OS/c1-3-7-12-13(20-17-16-12)14(19)18(4-2)10-11-8-5-6-9-15-11/h11,15H,3-10H2,1-2H3.
What are the key properties of N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide?
N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide has a molecular weight of 296.44 g/mol, XLogP of 2.09, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide is sourced from PubChem (CID 106626170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).