1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane

C10H22N2O2S — CID 127614586

IUPAC1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane
SMILESCC(C)C1CCC(CNS(N)(=O)=O)CC1
InChIInChI=1S/C10H22N2O2S/c1-8(2)10-5-3-9(4-6-10)7-12-15(11,13)14/h8-10,12H,3-7H2,1-2H3,(H2,11,13,14)
InChIKeyRYMBZBDQRQMXNX-UHFFFAOYSA-N
MW234.36 g/mol
LogP1.24
Rot. Bonds4

About 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane

1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane (PubChem CID 127614586) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane.

Molecular Properties

Compound Name1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane
PubChem CID127614586
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC Name1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane
SMILESCC(C)C1CCC(CNS(N)(=O)=O)CC1
InChIInChI=1S/C10H22N2O2S/c1-8(2)10-5-3-9(4-6-10)7-12-15(11,13)14/h8-10,12H,3-7H2,1-2H3,(H2,11,13,14)
InChIKeyRYMBZBDQRQMXNX-UHFFFAOYSA-N
XLogP1.24
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane?
The IUPAC name of 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane (CID 127614586) is 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane.
What is the SMILES notation for 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane?
The canonical SMILES for 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane is CC(C)C1CCC(CNS(N)(=O)=O)CC1.
What is the InChIKey of 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane?
The InChIKey is RYMBZBDQRQMXNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-8(2)10-5-3-9(4-6-10)7-12-15(11,13)14/h8-10,12H,3-7H2,1-2H3,(H2,11,13,14).
What are the key properties of 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane?
1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane has a molecular weight of 234.36 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-4-[(sulfamoylamino)methyl]cyclohexane is sourced from PubChem (CID 127614586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).