N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine

C12H17NS — CID 130525491

IUPACN-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine
SMILESC[C@@H](NC1CCC2CC21)c1cccs1
InChIInChI=1S/C12H17NS/c1-8(12-3-2-6-14-12)13-11-5-4-9-7-10(9)11/h2-3,6,8-11,13H,4-5,7H2,1H3/t8-,9?,10?,11?/m1/s1
InChIKeyYJLLJXZILLFBQF-XUHYKBHQSA-N
MW207.34 g/mol
LogP3.20
Rot. Bonds3

About N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine

N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine (PubChem CID 130525491) has the molecular formula C12H17NS and a molecular weight of 207.34 g/mol. Its IUPAC name is N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine.

Molecular Properties

Compound NameN-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine
PubChem CID130525491
Molecular FormulaC12H17NS
Molecular Weight207.34 g/mol
Exact Mass207.11
IUPAC NameN-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine
SMILESC[C@@H](NC1CCC2CC21)c1cccs1
InChIInChI=1S/C12H17NS/c1-8(12-3-2-6-14-12)13-11-5-4-9-7-10(9)11/h2-3,6,8-11,13H,4-5,7H2,1H3/t8-,9?,10?,11?/m1/s1
InChIKeyYJLLJXZILLFBQF-XUHYKBHQSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine with MolForge

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Related Compounds

2-cyclohexyl-N-[(1S)-1-thiophen-2-ylethyl]cyclohexan-1-amine
CID 81398668
trans-(1R,2R)-2-[[(1S)-1-thiophen-2-ylethyl]amino]cyclopentan-1-ol
CID 102733840
2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol
CID 60884836
2-methyl-N-[(1R)-1-thiophen-2-ylethyl]thiolan-3-amine
CID 102684058
2-(1-thiophen-2-ylethylamino)cycloheptan-1-ol
CID 60909745
2-methyl-N-[(1S)-1-thiophen-2-ylethyl]thian-3-amine
CID 81398612
2-pyrrolidin-2-yl-N-[(1S)-1-thiophen-2-ylethyl]cyclopentan-1-amine
CID 81398761
N-(1-thiophen-2-ylethyl)cyclohexanamine
CID 25219735
8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 81398172
3-propan-2-yl-N-(1-thiophen-2-ylethyl)cyclohexan-1-amine
CID 107447910
4-(1-thiophen-2-ylethylamino)cyclohexan-1-ol
CID 43193909
1,3-dimethyl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 115706103

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine?
The IUPAC name of N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine (CID 130525491) is N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine.
What is the SMILES notation for N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine?
The canonical SMILES for N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine is C[C@@H](NC1CCC2CC21)c1cccs1.
What is the InChIKey of N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine?
The InChIKey is YJLLJXZILLFBQF-XUHYKBHQSA-N. The full InChI is InChI=1S/C12H17NS/c1-8(12-3-2-6-14-12)13-11-5-4-9-7-10(9)11/h2-3,6,8-11,13H,4-5,7H2,1H3/t8-,9?,10?,11?/m1/s1.
What are the key properties of N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine?
N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine has a molecular weight of 207.34 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-thiophen-2-ylethyl]bicyclo[3.1.0]hexan-2-amine is sourced from PubChem (CID 130525491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).