[1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol

C9H19NOS — CID 79646857

IUPAC[1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol
SMILESCCNC1(CO)CCC(SC)C1
InChIInChI=1S/C9H19NOS/c1-3-10-9(7-11)5-4-8(6-9)12-2/h8,10-11H,3-7H2,1-2H3
InChIKeyZIBHMDLZGVLGJD-UHFFFAOYSA-N
MW189.32 g/mol
LogP1.24
Rot. Bonds4

About [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol

[1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol (PubChem CID 79646857) has the molecular formula C9H19NOS and a molecular weight of 189.32 g/mol. Its IUPAC name is [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol.

Molecular Properties

Compound Name[1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol
PubChem CID79646857
Molecular FormulaC9H19NOS
Molecular Weight189.32 g/mol
Exact Mass189.12
IUPAC Name[1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol
SMILESCCNC1(CO)CCC(SC)C1
InChIInChI=1S/C9H19NOS/c1-3-10-9(7-11)5-4-8(6-9)12-2/h8,10-11H,3-7H2,1-2H3
InChIKeyZIBHMDLZGVLGJD-UHFFFAOYSA-N
XLogP1.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.32
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(2-bromophenyl)sulfanyl-1-(ethylamino)cyclopentyl]methanol
CID 79647837
[3-(2-chlorophenyl)sulfanyl-1-(ethylamino)cyclopentyl]methanol
CID 79645308
[1-(ethylamino)-3-pentylsulfanylcyclohexyl]methanol
CID 107764670
[3-(3,4-dichlorophenyl)sulfanyl-1-(ethylamino)cyclopentyl]methanol
CID 79644568
[1-(ethylamino)-3-propoxycyclopentyl]methanol
CID 79644520
[3-(2-bromophenyl)sulfanyl-1-(ethylamino)cyclohexyl]methanol
CID 79640217
[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol
CID 79655884
[1-(ethylamino)-3-[methyl(2-methylpropyl)amino]cyclopentyl]methanol
CID 79656684
[3-butylsulfanyl-1-(propylamino)cyclopentyl]methanol
CID 79644828
[3-[cyclopropyl(2-methylpropyl)amino]-1-(ethylamino)cyclopentyl]methanol
CID 79656461
[3-[butyl(cyclopropyl)amino]-1-(ethylamino)cyclopentyl]methanol
CID 79655971
[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol
CID 79656682

Frequently Asked Questions

What is the IUPAC name of [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol?
The IUPAC name of [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol (CID 79646857) is [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol.
What is the SMILES notation for [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol?
The canonical SMILES for [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol is CCNC1(CO)CCC(SC)C1.
What is the InChIKey of [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol?
The InChIKey is ZIBHMDLZGVLGJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NOS/c1-3-10-9(7-11)5-4-8(6-9)12-2/h8,10-11H,3-7H2,1-2H3.
What are the key properties of [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol?
[1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol has a molecular weight of 189.32 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol is sourced from PubChem (CID 79646857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).