2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide

C12H24N2OS — CID 66223801

IUPAC2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide
SMILESCC(C)(N)CSCC(=O)NC1CCCCC1
InChIInChI=1S/C12H24N2OS/c1-12(2,13)9-16-8-11(15)14-10-6-4-3-5-7-10/h10H,3-9,13H2,1-2H3,(H,14,15)
InChIKeySNSRDTACFAQGHQ-UHFFFAOYSA-N
MW244.40 g/mol
LogP1.91
Rot. Bonds5

About 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide

2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide (PubChem CID 66223801) has the molecular formula C12H24N2OS and a molecular weight of 244.40 g/mol. Its IUPAC name is 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide
PubChem CID66223801
Molecular FormulaC12H24N2OS
Molecular Weight244.40 g/mol
Exact Mass244.16
IUPAC Name2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide
SMILESCC(C)(N)CSCC(=O)NC1CCCCC1
InChIInChI=1S/C12H24N2OS/c1-12(2,13)9-16-8-11(15)14-10-6-4-3-5-7-10/h10H,3-9,13H2,1-2H3,(H,14,15)
InChIKeySNSRDTACFAQGHQ-UHFFFAOYSA-N
XLogP1.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.40
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-amino-2-methylpropyl)sulfanyl-N-cyclopentylacetamide
CID 66221452
ethyl 2-[2-(cyclooctylamino)-2-oxoethyl]sulfanylacetate
CID 78760581
2-(3-aminobutylsulfanyl)-N-cycloheptylacetamide
CID 66232120
2-(cyclopropylamino)-3-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-2-methylpropanoic acid
CID 114234494
N-cyclodecylpropanamide
CID 122483649
N-cyclododecylpropanamide
CID 2784600
N-cyclooctylpropanamide
CID 3387497
2-(cyanomethylsulfanyl)-N-cyclohexylacetamide
CID 60746455
N-cyclohexyl-2-(3-hydroxy-2-methylpropyl)sulfanylacetamide
CID 66105990
N-cycloheptyl-2-(3-hydroxy-2-methylpropyl)sulfanylacetamide
CID 66105597
2-(2-amino-2-methylpropyl)sulfanyl-N-tert-butylacetamide
CID 66230207
2-amino-3-[2-(cyclopentylamino)-2-oxoethyl]sulfanylpropanoic acid
CID 43176432

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide?
The IUPAC name of 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide (CID 66223801) is 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide.
What is the SMILES notation for 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide?
The canonical SMILES for 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide is CC(C)(N)CSCC(=O)NC1CCCCC1.
What is the InChIKey of 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide?
The InChIKey is SNSRDTACFAQGHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2OS/c1-12(2,13)9-16-8-11(15)14-10-6-4-3-5-7-10/h10H,3-9,13H2,1-2H3,(H,14,15).
What are the key properties of 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide?
2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide has a molecular weight of 244.40 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-methylpropyl)sulfanyl-N-cyclohexylacetamide is sourced from PubChem (CID 66223801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).