1-amino-N-propylsulfonylcyclopropane-1-carboxamide

C7H14N2O3S — CID 103307629

IUPAC1-amino-N-propylsulfonylcyclopropane-1-carboxamide
SMILESCCCS(=O)(=O)NC(=O)C1(N)CC1
InChIInChI=1S/C7H14N2O3S/c1-2-5-13(11,12)9-6(10)7(8)3-4-7/h2-5,8H2,1H3,(H,9,10)
InChIKeyAWKIEVOUCXJSQG-UHFFFAOYSA-N
MW206.27 g/mol
LogP-0.67
Rot. Bonds4

About 1-amino-N-propylsulfonylcyclopropane-1-carboxamide

1-amino-N-propylsulfonylcyclopropane-1-carboxamide (PubChem CID 103307629) has the molecular formula C7H14N2O3S and a molecular weight of 206.27 g/mol. Its IUPAC name is 1-amino-N-propylsulfonylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-propylsulfonylcyclopropane-1-carboxamide
PubChem CID103307629
Molecular FormulaC7H14N2O3S
Molecular Weight206.27 g/mol
Exact Mass206.07
IUPAC Name1-amino-N-propylsulfonylcyclopropane-1-carboxamide
SMILESCCCS(=O)(=O)NC(=O)C1(N)CC1
InChIInChI=1S/C7H14N2O3S/c1-2-5-13(11,12)9-6(10)7(8)3-4-7/h2-5,8H2,1H3,(H,9,10)
InChIKeyAWKIEVOUCXJSQG-UHFFFAOYSA-N
XLogP-0.67
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-propylsulfonylcyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-propylsulfonylcyclopropane-1-carboxamide (CID 103307629) is 1-amino-N-propylsulfonylcyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-propylsulfonylcyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-propylsulfonylcyclopropane-1-carboxamide is CCCS(=O)(=O)NC(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N-propylsulfonylcyclopropane-1-carboxamide?
The InChIKey is AWKIEVOUCXJSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3S/c1-2-5-13(11,12)9-6(10)7(8)3-4-7/h2-5,8H2,1H3,(H,9,10).
What are the key properties of 1-amino-N-propylsulfonylcyclopropane-1-carboxamide?
1-amino-N-propylsulfonylcyclopropane-1-carboxamide has a molecular weight of 206.27 g/mol, XLogP of -0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-propylsulfonylcyclopropane-1-carboxamide is sourced from PubChem (CID 103307629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).