(2-methyl-3H-thiophen-2-yl)methanamine

C6H11NS — CID 57267257

IUPAC(2-methyl-3H-thiophen-2-yl)methanamine
SMILESCC1(CN)CC=CS1
InChIInChI=1S/C6H11NS/c1-6(5-7)3-2-4-8-6/h2,4H,3,5,7H2,1H3
InChIKeyJXQJRXMUQKZNSX-UHFFFAOYSA-N
MW129.23 g/mol
LogP1.35
Rot. Bonds1

About (2-methyl-3H-thiophen-2-yl)methanamine

(2-methyl-3H-thiophen-2-yl)methanamine (PubChem CID 57267257) has the molecular formula C6H11NS and a molecular weight of 129.23 g/mol. Its IUPAC name is (2-methyl-3H-thiophen-2-yl)methanamine.

Molecular Properties

Compound Name(2-methyl-3H-thiophen-2-yl)methanamine
PubChem CID57267257
Molecular FormulaC6H11NS
Molecular Weight129.23 g/mol
Exact Mass129.06
IUPAC Name(2-methyl-3H-thiophen-2-yl)methanamine
SMILESCC1(CN)CC=CS1
InChIInChI=1S/C6H11NS/c1-6(5-7)3-2-4-8-6/h2,4H,3,5,7H2,1H3
InChIKeyJXQJRXMUQKZNSX-UHFFFAOYSA-N
XLogP1.35
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.23
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-propyl-3H-thiophen-2-yl)methanamine
CID 57030913
1-methyl-4-prop-2-enyl-4,5-dihydro-3H-1,2-thiazole
CID 67154371
2,3-Dihydrothiophen-2-ylmethanamine
CID 68270017
2-(2-methyl-3H-thiophen-2-yl)ethanamine
CID 68810050
2-(2-ethyl-3H-thiophen-2-yl)ethanamine
CID 68810150
2-(2,3-Dihydrothiophen-2-yl)ethanamine
CID 70315620
2-(2,3-Dihydrothiophen-3-yl)ethanamine
CID 89018226
1-(2,3-Dihydrothiophen-3-yl)ethanamine
CID 89045372
(3R)-3-methyl-1-methylsulfanylpent-4-en-2-amine
CID 89082277
(1S)-1-(2,3-dihydrothiophen-2-yl)ethanamine
CID 89246156
1-(2,3-Dihydrothiophen-2-yl)ethanamine
CID 89246157
2-Ethyl-3-methylsulfanylbut-3-en-1-amine
CID 123947277

Frequently Asked Questions

What is the IUPAC name of (2-methyl-3H-thiophen-2-yl)methanamine?
The IUPAC name of (2-methyl-3H-thiophen-2-yl)methanamine (CID 57267257) is (2-methyl-3H-thiophen-2-yl)methanamine.
What is the SMILES notation for (2-methyl-3H-thiophen-2-yl)methanamine?
The canonical SMILES for (2-methyl-3H-thiophen-2-yl)methanamine is CC1(CN)CC=CS1.
What is the InChIKey of (2-methyl-3H-thiophen-2-yl)methanamine?
The InChIKey is JXQJRXMUQKZNSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NS/c1-6(5-7)3-2-4-8-6/h2,4H,3,5,7H2,1H3.
What are the key properties of (2-methyl-3H-thiophen-2-yl)methanamine?
(2-methyl-3H-thiophen-2-yl)methanamine has a molecular weight of 129.23 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-3H-thiophen-2-yl)methanamine is sourced from PubChem (CID 57267257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).