1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide

C12H24N2O2S — CID 71057762

IUPAC1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide
SMILESC[C@H](NS(=O)(=O)CC1(N)CCCCC1)C1CC1
InChIInChI=1S/C12H24N2O2S/c1-10(11-5-6-11)14-17(15,16)9-12(13)7-3-2-4-8-12/h10-11,14H,2-9,13H2,1H3/t10-/m0/s1
InChIKeyOIXUNGUOANGMAP-JTQLQIEISA-N
MW260.40 g/mol
LogP1.37
Rot. Bonds5

About 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide

1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide (PubChem CID 71057762) has the molecular formula C12H24N2O2S and a molecular weight of 260.40 g/mol. Its IUPAC name is 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide.

Molecular Properties

Compound Name1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide
PubChem CID71057762
Molecular FormulaC12H24N2O2S
Molecular Weight260.40 g/mol
Exact Mass260.16
IUPAC Name1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide
SMILESC[C@H](NS(=O)(=O)CC1(N)CCCCC1)C1CC1
InChIInChI=1S/C12H24N2O2S/c1-10(11-5-6-11)14-17(15,16)9-12(13)7-3-2-4-8-12/h10-11,14H,2-9,13H2,1H3/t10-/m0/s1
InChIKeyOIXUNGUOANGMAP-JTQLQIEISA-N
XLogP1.37
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.40
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide?
The IUPAC name of 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide (CID 71057762) is 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide.
What is the SMILES notation for 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide?
The canonical SMILES for 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide is C[C@H](NS(=O)(=O)CC1(N)CCCCC1)C1CC1.
What is the InChIKey of 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide?
The InChIKey is OIXUNGUOANGMAP-JTQLQIEISA-N. The full InChI is InChI=1S/C12H24N2O2S/c1-10(11-5-6-11)14-17(15,16)9-12(13)7-3-2-4-8-12/h10-11,14H,2-9,13H2,1H3/t10-/m0/s1.
What are the key properties of 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide?
1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide has a molecular weight of 260.40 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminocyclohexyl)-N-[(1S)-1-cyclopropylethyl]methanesulfonamide is sourced from PubChem (CID 71057762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).