tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate

C15H24N4O4S — CID 139519272

IUPACtert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate
SMILESCCC(NC(=O)OC(C)(C)C)c1cncc(NS(=O)(=O)C2CC2)n1
InChIInChI=1S/C15H24N4O4S/c1-5-11(18-14(20)23-15(2,3)4)12-8-16-9-13(17-12)19-24(21,22)10-6-7-10/h8-11H,5-7H2,1-4H3,(H,17,19)(H,18,20)
InChIKeyNTNGTMHIEZSJOH-UHFFFAOYSA-N
MW356.45 g/mol
LogP2.36
Rot. Bonds6

About tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate

tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate (PubChem CID 139519272) has the molecular formula C15H24N4O4S and a molecular weight of 356.45 g/mol. Its IUPAC name is tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate
PubChem CID139519272
Molecular FormulaC15H24N4O4S
Molecular Weight356.45 g/mol
Exact Mass356.15
IUPAC Nametert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate
SMILESCCC(NC(=O)OC(C)(C)C)c1cncc(NS(=O)(=O)C2CC2)n1
InChIInChI=1S/C15H24N4O4S/c1-5-11(18-14(20)23-15(2,3)4)12-8-16-9-13(17-12)19-24(21,22)10-6-7-10/h8-11H,5-7H2,1-4H3,(H,17,19)(H,18,20)
InChIKeyNTNGTMHIEZSJOH-UHFFFAOYSA-N
XLogP2.36
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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tert-butyl N-[1-[2-(cyclopropylsulfonylamino)-1,3-thiazol-4-yl]-2-[4-(6-ethoxypyrazin-2-yl)anilino]-2-oxoethyl]carbamate
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3-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]-4-(6-ethoxypyrazin-2-yl)-2-fluorobenzamide
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tert-butyl N-[(1R)-1-[3-[1-(oxolan-3-yl)ethyl]imidazol-4-yl]propyl]carbamate
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tert-butyl N-[(1R)-1-[3-(1-methylsulfanylbutan-2-yl)imidazol-4-yl]propyl]carbamate
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tert-butyl N-[(1R)-1-(2-hydroxyphenyl)propyl]carbamate
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tert-butyl N-[(1S)-1-(2-bromo-4-chlorophenyl)propyl]carbamate
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tert-butyl N-[1-(1,3-thiazol-2-yl)propyl]carbamate
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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate?
The IUPAC name of tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate (CID 139519272) is tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate.
What is the SMILES notation for tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate?
The canonical SMILES for tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate is CCC(NC(=O)OC(C)(C)C)c1cncc(NS(=O)(=O)C2CC2)n1.
What is the InChIKey of tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate?
The InChIKey is NTNGTMHIEZSJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O4S/c1-5-11(18-14(20)23-15(2,3)4)12-8-16-9-13(17-12)19-24(21,22)10-6-7-10/h8-11H,5-7H2,1-4H3,(H,17,19)(H,18,20).
What are the key properties of tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate?
tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate has a molecular weight of 356.45 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[1-[6-(cyclopropylsulfonylamino)pyrazin-2-yl]propyl]carbamate is sourced from PubChem (CID 139519272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).