1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide

C8H14N2O2S — CID 70333499

IUPAC1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide
SMILESCC1(S(=O)NC(=O)C2(N)CC2)CC1
InChIInChI=1S/C8H14N2O2S/c1-7(2-3-7)13(12)10-6(11)8(9)4-5-8/h2-5,9H2,1H3,(H,10,11)
InChIKeyQWGCMOGBDLVWGV-UHFFFAOYSA-N
MW202.28 g/mol
LogP-0.19
Rot. Bonds3

About 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide

1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide (PubChem CID 70333499) has the molecular formula C8H14N2O2S and a molecular weight of 202.28 g/mol. Its IUPAC name is 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide
PubChem CID70333499
Molecular FormulaC8H14N2O2S
Molecular Weight202.28 g/mol
Exact Mass202.08
IUPAC Name1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide
SMILESCC1(S(=O)NC(=O)C2(N)CC2)CC1
InChIInChI=1S/C8H14N2O2S/c1-7(2-3-7)13(12)10-6(11)8(9)4-5-8/h2-5,9H2,1H3,(H,10,11)
InChIKeyQWGCMOGBDLVWGV-UHFFFAOYSA-N
XLogP-0.19
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide (CID 70333499) is 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide is CC1(S(=O)NC(=O)C2(N)CC2)CC1.
What is the InChIKey of 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide?
The InChIKey is QWGCMOGBDLVWGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2S/c1-7(2-3-7)13(12)10-6(11)8(9)4-5-8/h2-5,9H2,1H3,(H,10,11).
What are the key properties of 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide?
1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide has a molecular weight of 202.28 g/mol, XLogP of -0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(1-methylcyclopropyl)sulfinylcyclopropane-1-carboxamide is sourced from PubChem (CID 70333499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).