N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide

C10H15N3OS — CID 30796558

IUPACN-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)N[C@H](C)C1CC1
InChIInChI=1S/C10H15N3OS/c1-3-8-9(15-13-12-8)10(14)11-6(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H,11,14)/t6-/m1/s1
InChIKeyPXXZMUWARSRTSK-ZCFIWIBFSA-N
MW225.32 g/mol
LogP1.63
Rot. Bonds4

About N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide

N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide (PubChem CID 30796558) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide
PubChem CID30796558
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC NameN-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)N[C@H](C)C1CC1
InChIInChI=1S/C10H15N3OS/c1-3-8-9(15-13-12-8)10(14)11-6(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H,11,14)/t6-/m1/s1
InChIKeyPXXZMUWARSRTSK-ZCFIWIBFSA-N
XLogP1.63
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide?
The IUPAC name of N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide (CID 30796558) is N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide.
What is the SMILES notation for N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide?
The canonical SMILES for N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide is CCc1nnsc1C(=O)N[C@H](C)C1CC1.
What is the InChIKey of N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide?
The InChIKey is PXXZMUWARSRTSK-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-3-8-9(15-13-12-8)10(14)11-6(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H,11,14)/t6-/m1/s1.
What are the key properties of N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide?
N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide has a molecular weight of 225.32 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide is sourced from PubChem (CID 30796558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).