N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine

C10H21NOS — CID 115664082

IUPACN-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine
SMILESCOCC(C)NC1CCC(SC)C1
InChIInChI=1S/C10H21NOS/c1-8(7-12-2)11-9-4-5-10(6-9)13-3/h8-11H,4-7H2,1-3H3
InChIKeyOWCKFOHPUOKULZ-UHFFFAOYSA-N
MW203.35 g/mol
LogP1.89
Rot. Bonds5

About N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine

N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine (PubChem CID 115664082) has the molecular formula C10H21NOS and a molecular weight of 203.35 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine
PubChem CID115664082
Molecular FormulaC10H21NOS
Molecular Weight203.35 g/mol
Exact Mass203.13
IUPAC NameN-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine
SMILESCOCC(C)NC1CCC(SC)C1
InChIInChI=1S/C10H21NOS/c1-8(7-12-2)11-9-4-5-10(6-9)13-3/h8-11H,4-7H2,1-3H3
InChIKeyOWCKFOHPUOKULZ-UHFFFAOYSA-N
XLogP1.89
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.35
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxy-4-methylpentan-2-yl)-3-methylsulfanylcyclopentan-1-amine
CID 115724640
cis-(1S,3R)-N-[(2S)-1-methoxypropan-2-yl]-3-methylcyclopentan-1-amine
CID 95368713
4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol
CID 62535244
N-(1-cyclopropylethyl)-3-methylsulfanylcyclopentan-1-amine
CID 115677390
3-methylsulfanyl-N-[1-(oxolan-2-yl)propan-2-yl]cyclopentan-1-amine
CID 115724680
N-(2-methylpropyl)-3-methylsulfanylcyclopentan-1-amine
CID 115876615
4-[2-[(3-methylsulfanylcyclopentyl)amino]propyl]phenol
CID 114122743
4-(4-chlorophenyl)sulfanyl-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine
CID 97332983
3-N-(1-methoxypropan-2-yl)-1-N,1-N-dimethylcyclohexane-1,3-diamine
CID 115726744
N-[1-(2-methoxyethoxy)propan-2-yl]-3-methylcyclopentan-1-amine
CID 115891950
N-methyl-3-methylsulfanylcyclopentan-1-amine
CID 54595737
3-methylsulfanyl-N-(4,4,4-trifluorobutan-2-yl)cyclohexan-1-amine
CID 115721245

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine (CID 115664082) is N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine is COCC(C)NC1CCC(SC)C1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine?
The InChIKey is OWCKFOHPUOKULZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NOS/c1-8(7-12-2)11-9-4-5-10(6-9)13-3/h8-11H,4-7H2,1-3H3.
What are the key properties of N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine?
N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine has a molecular weight of 203.35 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-3-methylsulfanylcyclopentan-1-amine is sourced from PubChem (CID 115664082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).