N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine

C12H17NS — CID 62595338

IUPACN-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine
SMILESc1csc(C2(CNC3CC3)CCC2)c1
InChIInChI=1S/C12H17NS/c1-3-11(14-8-1)12(6-2-7-12)9-13-10-4-5-10/h1,3,8,10,13H,2,4-7,9H2
InChIKeyHYBHHOXRRHFRFN-UHFFFAOYSA-N
MW207.34 g/mol
LogP2.92
Rot. Bonds4

About N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine

N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine (PubChem CID 62595338) has the molecular formula C12H17NS and a molecular weight of 207.34 g/mol. Its IUPAC name is N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine
PubChem CID62595338
Molecular FormulaC12H17NS
Molecular Weight207.34 g/mol
Exact Mass207.11
IUPAC NameN-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine
SMILESc1csc(C2(CNC3CC3)CCC2)c1
InChIInChI=1S/C12H17NS/c1-3-11(14-8-1)12(6-2-7-12)9-13-10-4-5-10/h1,3,8,10,13H,2,4-7,9H2
InChIKeyHYBHHOXRRHFRFN-UHFFFAOYSA-N
XLogP2.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.34
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-thiophen-2-ylcyclohexyl)methyl]cyclopropanamine
CID 62595162
(1-thiophen-2-ylcyclobutyl)methanol
CID 83682682
N-[(3-propyl-1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine
CID 65014158
1-(4-hydroxycyclohexyl)-3-[(1-thiophen-2-ylcyclohexyl)methyl]urea
CID 111440825
N-[(1-thiophen-2-ylcycloheptyl)methyl]propan-2-amine
CID 55095998
1-cyclohexyl-3-[(1-thiophen-2-ylcyclopropyl)methyl]urea
CID 30522444
N-[[1-(3-chloro-2-fluorophenyl)cyclobutyl]methyl]cyclopropanamine
CID 82805310
N-[[1-(3-bromophenyl)cyclopentyl]methyl]cyclopropanamine
CID 62595905
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[(1-thiophen-2-ylcyclohexyl)methyl]acetamide;hydrochloride
CID 119799189
(2S)-5-oxo-N-[(1-thiophen-2-ylcyclohexyl)methyl]pyrrolidine-2-carboxamide
CID 94221439
N-[(2-thiophen-2-ylspiro[3.3]heptan-2-yl)methyl]propan-1-amine
CID 65009716
N-[(4-thiophen-2-yloxan-4-yl)methyl]propan-2-amine
CID 62594784

Frequently Asked Questions

What is the IUPAC name of N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine?
The IUPAC name of N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine (CID 62595338) is N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine?
The canonical SMILES for N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine is c1csc(C2(CNC3CC3)CCC2)c1.
What is the InChIKey of N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine?
The InChIKey is HYBHHOXRRHFRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NS/c1-3-11(14-8-1)12(6-2-7-12)9-13-10-4-5-10/h1,3,8,10,13H,2,4-7,9H2.
What are the key properties of N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine?
N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine has a molecular weight of 207.34 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine is sourced from PubChem (CID 62595338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).