N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine

C14H28N2S — CID 114235583

IUPACN-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine
SMILESCCSC1CCC(NC2CCNCC2(C)C)C1
InChIInChI=1S/C14H28N2S/c1-4-17-12-6-5-11(9-12)16-13-7-8-15-10-14(13,2)3/h11-13,15-16H,4-10H2,1-3H3
InChIKeyZFVOATKUSYYHMX-UHFFFAOYSA-N
MW256.46 g/mol
LogP2.64
Rot. Bonds4

About N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine

N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine (PubChem CID 114235583) has the molecular formula C14H28N2S and a molecular weight of 256.46 g/mol. Its IUPAC name is N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine
PubChem CID114235583
Molecular FormulaC14H28N2S
Molecular Weight256.46 g/mol
Exact Mass256.20
IUPAC NameN-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine
SMILESCCSC1CCC(NC2CCNCC2(C)C)C1
InChIInChI=1S/C14H28N2S/c1-4-17-12-6-5-11(9-12)16-13-7-8-15-10-14(13,2)3/h11-13,15-16H,4-10H2,1-3H3
InChIKeyZFVOATKUSYYHMX-UHFFFAOYSA-N
XLogP2.64
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.46
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethylsulfanyl-N-(3-methoxycyclobutyl)cyclopentan-1-amine
CID 104871846
4-ethyl-N-(3-ethylsulfanylcyclopentyl)cycloheptan-1-amine
CID 114122927
3-ethylsulfanyl-N-(2-ethylsulfanylethyl)cyclopentan-1-amine
CID 102672441
N-(3-ethylsulfanylcyclopentyl)piperidine-3-sulfonamide
CID 114123744
4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide
CID 103787245
N-(3-ethylsulfanylcyclopentyl)-2-methylsulfonylcyclohexan-1-amine
CID 75516655
1-ethyl-3-(3-ethylsulfanylcyclopentyl)-1-methylurea
CID 103715144
N-(3,3-dimethylbutan-2-yl)-3-ethylsulfanylcyclopentan-1-amine
CID 115910663
1-ethyl-N-(3-ethylsulfanylcyclopentyl)-3-methylpiperidin-4-amine
CID 75428467
cis-(1S,3R)-3-ethylsulfanyl-N-[[(3S)-thiolan-3-yl]methyl]cyclopentan-1-amine
CID 124677579
ethane;3-ethylsulfanylpyrrolidine
CID 143798471
ethyl 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxylate
CID 103926013

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine?
The IUPAC name of N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine (CID 114235583) is N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine.
What is the SMILES notation for N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine?
The canonical SMILES for N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine is CCSC1CCC(NC2CCNCC2(C)C)C1.
What is the InChIKey of N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine?
The InChIKey is ZFVOATKUSYYHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2S/c1-4-17-12-6-5-11(9-12)16-13-7-8-15-10-14(13,2)3/h11-13,15-16H,4-10H2,1-3H3.
What are the key properties of N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine?
N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine has a molecular weight of 256.46 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylsulfanylcyclopentyl)-3,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 114235583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).