N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide

C14H26N2O3S — CID 89233908

IUPACN-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide
SMILESCC(C)N(C1CC1)S(=O)(=O)CC1(NC=O)CCCCC1
InChIInChI=1S/C14H26N2O3S/c1-12(2)16(13-6-7-13)20(18,19)10-14(15-11-17)8-4-3-5-9-14/h11-13H,3-10H2,1-2H3,(H,15,17)
InChIKeyJLAUAPWQJPDNTQ-UHFFFAOYSA-N
MW302.44 g/mol
LogP1.64
Rot. Bonds7

About N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide

N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide (PubChem CID 89233908) has the molecular formula C14H26N2O3S and a molecular weight of 302.44 g/mol. Its IUPAC name is N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide.

Molecular Properties

Compound NameN-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide
PubChem CID89233908
Molecular FormulaC14H26N2O3S
Molecular Weight302.44 g/mol
Exact Mass302.17
IUPAC NameN-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide
SMILESCC(C)N(C1CC1)S(=O)(=O)CC1(NC=O)CCCCC1
InChIInChI=1S/C14H26N2O3S/c1-12(2)16(13-6-7-13)20(18,19)10-14(15-11-17)8-4-3-5-9-14/h11-13H,3-10H2,1-2H3,(H,15,17)
InChIKeyJLAUAPWQJPDNTQ-UHFFFAOYSA-N
XLogP1.64
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide?
The IUPAC name of N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide (CID 89233908) is N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide.
What is the SMILES notation for N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide?
The canonical SMILES for N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide is CC(C)N(C1CC1)S(=O)(=O)CC1(NC=O)CCCCC1.
What is the InChIKey of N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide?
The InChIKey is JLAUAPWQJPDNTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3S/c1-12(2)16(13-6-7-13)20(18,19)10-14(15-11-17)8-4-3-5-9-14/h11-13H,3-10H2,1-2H3,(H,15,17).
What are the key properties of N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide?
N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide has a molecular weight of 302.44 g/mol, XLogP of 1.64, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[[cyclopropyl(propan-2-yl)sulfamoyl]methyl]cyclohexyl]formamide is sourced from PubChem (CID 89233908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).