N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide

C7H14N2O3S — CID 60681465

IUPACN-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide
SMILESCS(=O)(=O)NCCNC(=O)C1CC1
InChIInChI=1S/C7H14N2O3S/c1-13(11,12)9-5-4-8-7(10)6-2-3-6/h6,9H,2-5H2,1H3,(H,8,10)
InChIKeyBOZAXMPXOYPVQR-UHFFFAOYSA-N
MW206.27 g/mol
LogP-0.94
Rot. Bonds5

About N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide

N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide (PubChem CID 60681465) has the molecular formula C7H14N2O3S and a molecular weight of 206.27 g/mol. Its IUPAC name is N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide
PubChem CID60681465
Molecular FormulaC7H14N2O3S
Molecular Weight206.27 g/mol
Exact Mass206.07
IUPAC NameN-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide
SMILESCS(=O)(=O)NCCNC(=O)C1CC1
InChIInChI=1S/C7H14N2O3S/c1-13(11,12)9-5-4-8-7(10)6-2-3-6/h6,9H,2-5H2,1H3,(H,8,10)
InChIKeyBOZAXMPXOYPVQR-UHFFFAOYSA-N
XLogP-0.94
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 5-0.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide (CID 60681465) is N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide is CS(=O)(=O)NCCNC(=O)C1CC1.
What is the InChIKey of N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide?
The InChIKey is BOZAXMPXOYPVQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3S/c1-13(11,12)9-5-4-8-7(10)6-2-3-6/h6,9H,2-5H2,1H3,(H,8,10).
What are the key properties of N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide?
N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide has a molecular weight of 206.27 g/mol, XLogP of -0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methanesulfonamido)ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 60681465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).