2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide

C13H26N2O2S — CID 114123610

IUPAC2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide
SMILESCCSC1CCC(NCC(=O)NC(C)COC)C1
InChIInChI=1S/C13H26N2O2S/c1-4-18-12-6-5-11(7-12)14-8-13(16)15-10(2)9-17-3/h10-12,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyFRLWMLPJZHESNC-UHFFFAOYSA-N
MW274.43 g/mol
LogP1.40
Rot. Bonds8

About 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide

2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide (PubChem CID 114123610) has the molecular formula C13H26N2O2S and a molecular weight of 274.43 g/mol. Its IUPAC name is 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide.

Molecular Properties

Compound Name2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide
PubChem CID114123610
Molecular FormulaC13H26N2O2S
Molecular Weight274.43 g/mol
Exact Mass274.17
IUPAC Name2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide
SMILESCCSC1CCC(NCC(=O)NC(C)COC)C1
InChIInChI=1S/C13H26N2O2S/c1-4-18-12-6-5-11(7-12)14-8-13(16)15-10(2)9-17-3/h10-12,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyFRLWMLPJZHESNC-UHFFFAOYSA-N
XLogP1.40
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-hydroxycyclohexyl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 62360031
N-(1-methoxypropan-2-yl)-2-(oxan-3-ylamino)acetamide
CID 63363442
N-(1-methoxypropan-2-yl)-2-[(1-methylsulfonylpiperidin-4-yl)amino]acetamide
CID 60976886
2-[(3-methylcyclopentyl)amino]-N-pentan-2-ylacetamide
CID 114545702
2-[(2,3-dimethylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 64909596
2-[[(1S)-1-cyclopentylethyl]amino]-N-(1-methoxypropan-2-yl)acetamide
CID 81394863
methyl 2-[[2-(cyclopropylamino)acetyl]amino]propanoate
CID 60687311
2-amino-N-(3-ethylsulfanylcyclopentyl)propanamide
CID 103797921
2-(1-cyclopropylethylamino)-N-(1-methoxypropan-2-yl)acetamide
CID 60696176
3-[[2-(cyclopropylamino)acetyl]amino]butanoic acid
CID 61160049
2-(cyclopentylamino)-N-(1-methoxy-3-methylbutan-2-yl)acetamide
CID 65049389
2-[(3-methoxycyclopentyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 114117988

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide?
The IUPAC name of 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide (CID 114123610) is 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide.
What is the SMILES notation for 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide?
The canonical SMILES for 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide is CCSC1CCC(NCC(=O)NC(C)COC)C1.
What is the InChIKey of 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide?
The InChIKey is FRLWMLPJZHESNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2S/c1-4-18-12-6-5-11(7-12)14-8-13(16)15-10(2)9-17-3/h10-12,14H,4-9H2,1-3H3,(H,15,16).
What are the key properties of 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide?
2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide has a molecular weight of 274.43 g/mol, XLogP of 1.40, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethylsulfanylcyclopentyl)amino]-N-(1-methoxypropan-2-yl)acetamide is sourced from PubChem (CID 114123610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).