6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide

C14H28N2OS — CID 114121464

IUPAC6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide
SMILESCSC1CCCC1NC(=O)CCC(C)(C)CCN
InChIInChI=1S/C14H28N2OS/c1-14(2,9-10-15)8-7-13(17)16-11-5-4-6-12(11)18-3/h11-12H,4-10,15H2,1-3H3,(H,16,17)
InChIKeyLIALNYAXXVANOJ-UHFFFAOYSA-N
MW272.46 g/mol
LogP2.54
Rot. Bonds7

About 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide

6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide (PubChem CID 114121464) has the molecular formula C14H28N2OS and a molecular weight of 272.46 g/mol. Its IUPAC name is 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide.

Molecular Properties

Compound Name6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide
PubChem CID114121464
Molecular FormulaC14H28N2OS
Molecular Weight272.46 g/mol
Exact Mass272.19
IUPAC Name6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide
SMILESCSC1CCCC1NC(=O)CCC(C)(C)CCN
InChIInChI=1S/C14H28N2OS/c1-14(2,9-10-15)8-7-13(17)16-11-5-4-6-12(11)18-3/h11-12H,4-10,15H2,1-3H3,(H,16,17)
InChIKeyLIALNYAXXVANOJ-UHFFFAOYSA-N
XLogP2.54
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-(2-cyanocyclopentyl)-4,4-dimethylhexanamide
CID 65291034
N-(2-methylsulfanylcyclopentyl)-3-piperidin-4-ylpropanamide
CID 113343493
4-[(6-amino-4,4-dimethylhexanoyl)amino]cyclohexane-1-carboxamide
CID 65290886
N-(2-methylsulfanylcyclopentyl)-3-piperidin-4-yloxypropanamide
CID 103920718
6-amino-4,4-dimethyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)hexanamide
CID 65472003
N-[2-(aminomethyl)cyclopentyl]-4,4-dimethylpentanamide;hydrochloride
CID 119605302
3-amino-N-(2-methylsulfanylcyclohexyl)butanamide
CID 103812043
6-amino-4,4-dimethyl-N-(oxan-3-yl)hexanamide
CID 65291525
N-(2-methylsulfanylcyclohexyl)-3-pyrrolidin-3-ylpropanamide
CID 103859937
1-(2-hydroxy-2-methylpropyl)-3-[(1S,2R)-2-methylsulfanylcyclopentyl]urea
CID 96565833
(2S)-2-amino-N-(2-methylsulfanylcyclopentyl)propanamide
CID 103797253
6-amino-N-(3,5-dimethylcyclohexyl)-4,4-dimethylhexanamide
CID 65291109

Frequently Asked Questions

What is the IUPAC name of 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide?
The IUPAC name of 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide (CID 114121464) is 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide.
What is the SMILES notation for 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide?
The canonical SMILES for 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide is CSC1CCCC1NC(=O)CCC(C)(C)CCN.
What is the InChIKey of 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide?
The InChIKey is LIALNYAXXVANOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2OS/c1-14(2,9-10-15)8-7-13(17)16-11-5-4-6-12(11)18-3/h11-12H,4-10,15H2,1-3H3,(H,16,17).
What are the key properties of 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide?
6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide has a molecular weight of 272.46 g/mol, XLogP of 2.54, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4,4-dimethyl-N-(2-methylsulfanylcyclopentyl)hexanamide is sourced from PubChem (CID 114121464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).