2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide

C13H26N2OS — CID 103812914

IUPAC2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC1CCCC1SCC
InChIInChI=1S/C13H26N2OS/c1-4-9-13(3,14)12(16)15-10-7-6-8-11(10)17-5-2/h10-11H,4-9,14H2,1-3H3,(H,15,16)
InChIKeyWGNUTLZEAISJPC-UHFFFAOYSA-N
MW258.43 g/mol
LogP2.29
Rot. Bonds6

About 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide

2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide (PubChem CID 103812914) has the molecular formula C13H26N2OS and a molecular weight of 258.43 g/mol. Its IUPAC name is 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide
PubChem CID103812914
Molecular FormulaC13H26N2OS
Molecular Weight258.43 g/mol
Exact Mass258.18
IUPAC Name2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC1CCCC1SCC
InChIInChI=1S/C13H26N2OS/c1-4-9-13(3,14)12(16)15-10-7-6-8-11(10)17-5-2/h10-11H,4-9,14H2,1-3H3,(H,15,16)
InChIKeyWGNUTLZEAISJPC-UHFFFAOYSA-N
XLogP2.29
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.43
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide
CID 107222009
(2R)-2-amino-N-(2-ethylsulfanylcyclopentyl)butanamide
CID 104878228
2-amino-N-(2-ethylsulfanylcyclohexyl)acetamide
CID 119337962
3-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylbutanamide
CID 103581059
N-(2-ethylsulfanylcyclopentyl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119818862
2-amino-N-(2-ethylsulfanylcyclopentyl)-3-methylbutanamide;hydrochloride
CID 119343710
N-(2-ethylsulfanylcyclopentyl)-4-methylpiperidine-4-carboxamide
CID 103840385
3-[(2-ethylsulfanylcyclopentyl)carbamoylamino]-2,2-dimethylpropanoic acid
CID 114121881
2-amino-N-(2-ethylsulfanylcyclohexyl)propanamide;hydrochloride
CID 119337965
(2R)-2-amino-N-(2-ethylsulfanylcyclohexyl)propanamide;hydrochloride
CID 119337969
2-amino-N-(2-imidazol-1-ylcyclopentyl)-2-methylpentanamide
CID 60847019
1-cyclopropyl-3-(2-ethylsulfanylcyclopentyl)thiourea
CID 103727711

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide?
The IUPAC name of 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide (CID 103812914) is 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide?
The canonical SMILES for 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide is CCCC(C)(N)C(=O)NC1CCCC1SCC.
What is the InChIKey of 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide?
The InChIKey is WGNUTLZEAISJPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2OS/c1-4-9-13(3,14)12(16)15-10-7-6-8-11(10)17-5-2/h10-11H,4-9,14H2,1-3H3,(H,15,16).
What are the key properties of 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide?
2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide has a molecular weight of 258.43 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide is sourced from PubChem (CID 103812914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).