1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine

C9H14N2S — CID 105440290

IUPAC1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine
SMILESCc1csnc1CCC1(N)CC1
InChIInChI=1S/C9H14N2S/c1-7-6-12-11-8(7)2-3-9(10)4-5-9/h6H,2-5,10H2,1H3
InChIKeyJJJRJWQOXOODBV-UHFFFAOYSA-N
MW182.29 g/mol
LogP1.88
Rot. Bonds3

About 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine

1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine (PubChem CID 105440290) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine
PubChem CID105440290
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC Name1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine
SMILESCc1csnc1CCC1(N)CC1
InChIInChI=1S/C9H14N2S/c1-7-6-12-11-8(7)2-3-9(10)4-5-9/h6H,2-5,10H2,1H3
InChIKeyJJJRJWQOXOODBV-UHFFFAOYSA-N
XLogP1.88
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine (CID 105440290) is 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine is Cc1csnc1CCC1(N)CC1.
What is the InChIKey of 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine?
The InChIKey is JJJRJWQOXOODBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c1-7-6-12-11-8(7)2-3-9(10)4-5-9/h6H,2-5,10H2,1H3.
What are the key properties of 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine?
1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine has a molecular weight of 182.29 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methyl-1,2-thiazol-3-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105440290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).