[1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol

C10H21NOS — CID 79645826

IUPAC[1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol
SMILESCNC1(CO)CCC(SC(C)C)C1
InChIInChI=1S/C10H21NOS/c1-8(2)13-9-4-5-10(6-9,7-12)11-3/h8-9,11-12H,4-7H2,1-3H3
InChIKeyKIMFHKINICMLHF-UHFFFAOYSA-N
MW203.35 g/mol
LogP1.63
Rot. Bonds4

About [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol

[1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol (PubChem CID 79645826) has the molecular formula C10H21NOS and a molecular weight of 203.35 g/mol. Its IUPAC name is [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol
PubChem CID79645826
Molecular FormulaC10H21NOS
Molecular Weight203.35 g/mol
Exact Mass203.13
IUPAC Name[1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol
SMILESCNC1(CO)CCC(SC(C)C)C1
InChIInChI=1S/C10H21NOS/c1-8(2)13-9-4-5-10(6-9,7-12)11-3/h8-9,11-12H,4-7H2,1-3H3
InChIKeyKIMFHKINICMLHF-UHFFFAOYSA-N
XLogP1.63
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.35
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(methylamino)-3-(3-methylbutan-2-ylsulfanyl)cyclopentyl]methanol
CID 107764767
[1-(methylamino)-3-(3-methylbutan-2-ylsulfanyl)cyclohexyl]methanol
CID 107764753
[3-cyclopentylsulfanyl-1-(methylamino)cyclopentyl]methanol
CID 79646566
[3-(cyclopentylmethylsulfanyl)-1-(methylamino)cyclopentyl]methanol
CID 79644808
[1-(methylamino)-3-[methyl(propan-2-yl)amino]cyclopentyl]methanol
CID 79656680
[3-butan-2-ylsulfanyl-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79646598
[1-(methylamino)-3-(5-methylpyrimidin-2-yl)sulfanylcyclopentyl]methanol
CID 79647631
[1-(methylamino)-3-(3-methylcyclohexyl)sulfanylcyclopentyl]methanol
CID 79645546
[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol
CID 79656781
[3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride
CID 155895170
[3-(3-methoxypropylsulfanyl)-1-(methylamino)cyclohexyl]methanol
CID 79640677
[1-(methylamino)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]cyclohexyl]methanol
CID 79640287

Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol?
The IUPAC name of [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol (CID 79645826) is [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol.
What is the SMILES notation for [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol?
The canonical SMILES for [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol is CNC1(CO)CCC(SC(C)C)C1.
What is the InChIKey of [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol?
The InChIKey is KIMFHKINICMLHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NOS/c1-8(2)13-9-4-5-10(6-9,7-12)11-3/h8-9,11-12H,4-7H2,1-3H3.
What are the key properties of [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol?
[1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol has a molecular weight of 203.35 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol is sourced from PubChem (CID 79645826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).