N-[(1R)-1-cyclopentylethyl]thiolan-3-amine

C11H21NS — CID 81394776

IUPACN-[(1R)-1-cyclopentylethyl]thiolan-3-amine
SMILESC[C@@H](NC1CCSC1)C1CCCC1
InChIInChI=1S/C11H21NS/c1-9(10-4-2-3-5-10)12-11-6-7-13-8-11/h9-12H,2-8H2,1H3/t9-,11?/m1/s1
InChIKeyYRZRGVNOSYXGIC-BFHBGLAWSA-N
MW199.36 g/mol
LogP2.66
Rot. Bonds3

About N-[(1R)-1-cyclopentylethyl]thiolan-3-amine

N-[(1R)-1-cyclopentylethyl]thiolan-3-amine (PubChem CID 81394776) has the molecular formula C11H21NS and a molecular weight of 199.36 g/mol. Its IUPAC name is N-[(1R)-1-cyclopentylethyl]thiolan-3-amine.

Molecular Properties

Compound NameN-[(1R)-1-cyclopentylethyl]thiolan-3-amine
PubChem CID81394776
Molecular FormulaC11H21NS
Molecular Weight199.36 g/mol
Exact Mass199.14
IUPAC NameN-[(1R)-1-cyclopentylethyl]thiolan-3-amine
SMILESC[C@@H](NC1CCSC1)C1CCCC1
InChIInChI=1S/C11H21NS/c1-9(10-4-2-3-5-10)12-11-6-7-13-8-11/h9-12H,2-8H2,1H3/t9-,11?/m1/s1
InChIKeyYRZRGVNOSYXGIC-BFHBGLAWSA-N
XLogP2.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.36
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(1-ethylpiperidin-3-yl)ethyl]thiolan-3-amine
CID 103062700
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-[(1R)-1-cyclopropylethyl]cyclopropanamine
CID 28819115
N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine
CID 63478862
N-[(1R)-1-cycloheptylethyl]-4-propan-2-ylcyclohexan-1-amine
CID 81393268
N-[(1S)-1-cyclohexylethyl]-4,4-dimethylthian-3-amine
CID 81387257
2-N-(thiolan-3-yl)propane-1,2-diamine
CID 103391245
N-(1-cyclopropylpropyl)thiolan-3-amine
CID 103902644
N-(1,1,1-trifluoropropan-2-yl)thiolan-3-amine
CID 130708891
(1S)-1-cyclopentyl-N-(thiolan-3-ylmethyl)ethanamine
CID 107132288
N-[(1S)-1-cycloheptylethyl]-4-propan-2-ylcycloheptan-1-amine
CID 81389643

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclopentylethyl]thiolan-3-amine?
The IUPAC name of N-[(1R)-1-cyclopentylethyl]thiolan-3-amine (CID 81394776) is N-[(1R)-1-cyclopentylethyl]thiolan-3-amine.
What is the SMILES notation for N-[(1R)-1-cyclopentylethyl]thiolan-3-amine?
The canonical SMILES for N-[(1R)-1-cyclopentylethyl]thiolan-3-amine is C[C@@H](NC1CCSC1)C1CCCC1.
What is the InChIKey of N-[(1R)-1-cyclopentylethyl]thiolan-3-amine?
The InChIKey is YRZRGVNOSYXGIC-BFHBGLAWSA-N. The full InChI is InChI=1S/C11H21NS/c1-9(10-4-2-3-5-10)12-11-6-7-13-8-11/h9-12H,2-8H2,1H3/t9-,11?/m1/s1.
What are the key properties of N-[(1R)-1-cyclopentylethyl]thiolan-3-amine?
N-[(1R)-1-cyclopentylethyl]thiolan-3-amine has a molecular weight of 199.36 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclopentylethyl]thiolan-3-amine is sourced from PubChem (CID 81394776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).