2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine

C11H17NS — CID 130991690

IUPAC2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine
SMILESCc1cc(C(C)NC2CC2C)cs1
InChIInChI=1S/C11H17NS/c1-7-4-11(7)12-9(3)10-5-8(2)13-6-10/h5-7,9,11-12H,4H2,1-3H3
InChIKeyUPKAYGJQJSVOBL-UHFFFAOYSA-N
MW195.33 g/mol
LogP3.12
Rot. Bonds3

About 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine

2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine (PubChem CID 130991690) has the molecular formula C11H17NS and a molecular weight of 195.33 g/mol. Its IUPAC name is 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine
PubChem CID130991690
Molecular FormulaC11H17NS
Molecular Weight195.33 g/mol
Exact Mass195.11
IUPAC Name2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine
SMILESCc1cc(C(C)NC2CC2C)cs1
InChIInChI=1S/C11H17NS/c1-7-4-11(7)12-9(3)10-5-8(2)13-6-10/h5-7,9,11-12H,4H2,1-3H3
InChIKeyUPKAYGJQJSVOBL-UHFFFAOYSA-N
XLogP3.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.33
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Methyl[(3-methylthiophen-2-yl)methyl]amine hydrochloride
CID 16187615
Tifacogin
CID 961320
Benzyl(1-(thiophen-2-yl)propan-2-yl)amine
CID 4868418
4,5,6,7-Tetrahydrothieno(3,2-c)pyridine
CID 3085076
7-methyl-4H,5H,6H,7H-thieno(2,3-c)pyridine
CID 14548169
N-[(3-methylthiophen-2-yl)methyl]cyclohexanamine
CID 4721499
Phenethyl-thiophen-2-ylmethyl-amine hydrochloride
CID 24746854
2-Methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
CID 18377285
N-[2-(4-fluorophenyl)ethyl]-N-[(3-methyl-2-thienyl)methyl]amine
CID 1817795
4-ethyl-4H,5H,6H,7H-thieno(3,2-c)pyridine
CID 6485296
4-cyclopropyl-4H,5H,6H,7H-thieno(3,2-c)pyridine
CID 6485297
N-benzyl(5-methyl-2-thienyl)methanamine
CID 4721388

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine (CID 130991690) is 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine is Cc1cc(C(C)NC2CC2C)cs1.
What is the InChIKey of 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine?
The InChIKey is UPKAYGJQJSVOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NS/c1-7-4-11(7)12-9(3)10-5-8(2)13-6-10/h5-7,9,11-12H,4H2,1-3H3.
What are the key properties of 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine?
2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine has a molecular weight of 195.33 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(5-methylthiophen-3-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 130991690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).