N-(1-methylcyclopentyl)-2-methylsulfanylacetamide

C9H17NOS — CID 131154660

IUPACN-(1-methylcyclopentyl)-2-methylsulfanylacetamide
SMILESCSCC(=O)NC1(C)CCCC1
InChIInChI=1S/C9H17NOS/c1-9(5-3-4-6-9)10-8(11)7-12-2/h3-7H2,1-2H3,(H,10,11)
InChIKeyINQSIYSVCWMEMO-UHFFFAOYSA-N
MW187.31 g/mol
LogP1.80
Rot. Bonds3

About N-(1-methylcyclopentyl)-2-methylsulfanylacetamide

N-(1-methylcyclopentyl)-2-methylsulfanylacetamide (PubChem CID 131154660) has the molecular formula C9H17NOS and a molecular weight of 187.31 g/mol. Its IUPAC name is N-(1-methylcyclopentyl)-2-methylsulfanylacetamide.

Molecular Properties

Compound NameN-(1-methylcyclopentyl)-2-methylsulfanylacetamide
PubChem CID131154660
Molecular FormulaC9H17NOS
Molecular Weight187.31 g/mol
Exact Mass187.10
IUPAC NameN-(1-methylcyclopentyl)-2-methylsulfanylacetamide
SMILESCSCC(=O)NC1(C)CCCC1
InChIInChI=1S/C9H17NOS/c1-9(5-3-4-6-9)10-8(11)7-12-2/h3-7H2,1-2H3,(H,10,11)
InChIKeyINQSIYSVCWMEMO-UHFFFAOYSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.31
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methylcyclohexyl)-3-sulfanylpropanamide
CID 107027315
2-[1-[(2-methylsulfanylacetyl)amino]cyclohexyl]acetic acid
CID 64671362
N-(1-methylcyclobutyl)propanamide
CID 115766065
N-(1-methylcyclopentyl)pent-4-ynamide
CID 130688553
2-(1-aminocyclopentyl)-N-(1-methylcyclopentyl)acetamide
CID 64677004
N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide
CID 79279826
2-(2-methoxyethylamino)-N-(1-methylcyclopentyl)acetamide
CID 79282104
N-[4-(chloromethyl)oxan-4-yl]-2-methylsulfanylacetamide
CID 106300644
3-amino-3-hydroxyimino-N-(1-methylcyclopentyl)propanamide
CID 77051955
3,3-dimethyl-5-[(1-methylcyclopentyl)amino]-5-oxopentanoic acid
CID 62934594
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-2-methylsulfanylacetamide
CID 114758008
2-(2-methoxyethylamino)-N-(1-methylcyclohexyl)acetamide;hydrochloride
CID 119736484

Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopentyl)-2-methylsulfanylacetamide?
The IUPAC name of N-(1-methylcyclopentyl)-2-methylsulfanylacetamide (CID 131154660) is N-(1-methylcyclopentyl)-2-methylsulfanylacetamide.
What is the SMILES notation for N-(1-methylcyclopentyl)-2-methylsulfanylacetamide?
The canonical SMILES for N-(1-methylcyclopentyl)-2-methylsulfanylacetamide is CSCC(=O)NC1(C)CCCC1.
What is the InChIKey of N-(1-methylcyclopentyl)-2-methylsulfanylacetamide?
The InChIKey is INQSIYSVCWMEMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NOS/c1-9(5-3-4-6-9)10-8(11)7-12-2/h3-7H2,1-2H3,(H,10,11).
What are the key properties of N-(1-methylcyclopentyl)-2-methylsulfanylacetamide?
N-(1-methylcyclopentyl)-2-methylsulfanylacetamide has a molecular weight of 187.31 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopentyl)-2-methylsulfanylacetamide is sourced from PubChem (CID 131154660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).