2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride

C10H21ClN2OS — CID 119343755

IUPAC2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride
SMILESCCSC1CCCC(NC(=O)CN)C1.Cl
InChIInChI=1S/C10H20N2OS.ClH/c1-2-14-9-5-3-4-8(6-9)12-10(13)7-11;/h8-9H,2-7,11H2,1H3,(H,12,13);1H
InChIKeyWVGPJWXRUJHFBI-UHFFFAOYSA-N
MW252.81 g/mol
LogP1.55
Rot. Bonds4

About 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride

2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride (PubChem CID 119343755) has the molecular formula C10H21ClN2OS and a molecular weight of 252.81 g/mol. Its IUPAC name is 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride
PubChem CID119343755
Molecular FormulaC10H21ClN2OS
Molecular Weight252.81 g/mol
Exact Mass252.11
IUPAC Name2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride
SMILESCCSC1CCCC(NC(=O)CN)C1.Cl
InChIInChI=1S/C10H20N2OS.ClH/c1-2-14-9-5-3-4-8(6-9)12-10(13)7-11;/h8-9H,2-7,11H2,1H3,(H,12,13);1H
InChIKeyWVGPJWXRUJHFBI-UHFFFAOYSA-N
XLogP1.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.81
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(3-ethylsulfanylcyclohexyl)cyclopentane-1-carboxamide;hydrochloride
CID 119343768
3-(2-aminophenyl)-N-(3-ethylsulfanylcyclohexyl)propanamide;hydrochloride
CID 120611790
2-[1-(aminomethyl)cyclobutyl]-N-(3-ethylsulfanylcyclopentyl)acetamide
CID 114123170
2-amino-N-(3-ethylsulfanylcyclohexyl)benzamide;hydrochloride
CID 119945965
N-(3-ethylsulfanylcyclopentyl)-4-oxopentanamide
CID 103713860
2-amino-N-(3-ethylsulfanylcyclopentyl)cyclopentane-1-carboxamide
CID 113267227
2-amino-N-(3-ethylsulfanylcyclohexyl)benzamide
CID 119945966
N-ethyl-3-ethylsulfanylcyclohexan-1-amine
CID 64715277
ethyl 4-[[(1R,3S)-3-ethylsulfanylcyclohexyl]amino]piperidine-1-carboxylate
CID 97056311
2-amino-N-(3-ethylsulfanylcyclopentyl)propanamide
CID 103797921
2-(2,6-difluoro-4-nitrophenyl)-N-[(1S,3S)-3-ethylsulfanylcyclohexyl]acetamide
CID 124885342
N-(3-ethylsulfanylcyclohexyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 71979348

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride (CID 119343755) is 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride is CCSC1CCCC(NC(=O)CN)C1.Cl.
What is the InChIKey of 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride?
The InChIKey is WVGPJWXRUJHFBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS.ClH/c1-2-14-9-5-3-4-8(6-9)12-10(13)7-11;/h8-9H,2-7,11H2,1H3,(H,12,13);1H.
What are the key properties of 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride?
2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride has a molecular weight of 252.81 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-ethylsulfanylcyclohexyl)acetamide;hydrochloride is sourced from PubChem (CID 119343755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).