N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide

C11H22N6O2S — CID 154757462

IUPACN-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide
SMILESCC(NC1CCCCC1NS(C)(=O)=O)c1nnnn1C
InChIInChI=1S/C11H22N6O2S/c1-8(11-13-15-16-17(11)2)12-9-6-4-5-7-10(9)14-20(3,18)19/h8-10,12,14H,4-7H2,1-3H3
InChIKeyNDNGYRNIWZODNH-UHFFFAOYSA-N
MW302.40 g/mol
LogP-0.28
Rot. Bonds5

About N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide

N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide (PubChem CID 154757462) has the molecular formula C11H22N6O2S and a molecular weight of 302.40 g/mol. Its IUPAC name is N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide
PubChem CID154757462
Molecular FormulaC11H22N6O2S
Molecular Weight302.40 g/mol
Exact Mass302.15
IUPAC NameN-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide
SMILESCC(NC1CCCCC1NS(C)(=O)=O)c1nnnn1C
InChIInChI=1S/C11H22N6O2S/c1-8(11-13-15-16-17(11)2)12-9-6-4-5-7-10(9)14-20(3,18)19/h8-10,12,14H,4-7H2,1-3H3
InChIKeyNDNGYRNIWZODNH-UHFFFAOYSA-N
XLogP-0.28
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide?
The IUPAC name of N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide (CID 154757462) is N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide.
What is the SMILES notation for N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide?
The canonical SMILES for N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide is CC(NC1CCCCC1NS(C)(=O)=O)c1nnnn1C.
What is the InChIKey of N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide?
The InChIKey is NDNGYRNIWZODNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N6O2S/c1-8(11-13-15-16-17(11)2)12-9-6-4-5-7-10(9)14-20(3,18)19/h8-10,12,14H,4-7H2,1-3H3.
What are the key properties of N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide?
N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide has a molecular weight of 302.40 g/mol, XLogP of -0.28, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(1-methyltetrazol-5-yl)ethylamino]cyclohexyl]methanesulfonamide is sourced from PubChem (CID 154757462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).