N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine

C8H15NS — CID 57261495

IUPACN-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine
SMILESCCNCC1(C)CC=CS1
InChIInChI=1S/C8H15NS/c1-3-9-7-8(2)5-4-6-10-8/h4,6,9H,3,5,7H2,1-2H3
InChIKeyAMMGYILKDPAOGM-UHFFFAOYSA-N
MW157.28 g/mol
LogP2.01
Rot. Bonds3

About N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine

N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine (PubChem CID 57261495) has the molecular formula C8H15NS and a molecular weight of 157.28 g/mol. Its IUPAC name is N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine
PubChem CID57261495
Molecular FormulaC8H15NS
Molecular Weight157.28 g/mol
Exact Mass157.09
IUPAC NameN-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine
SMILESCCNCC1(C)CC=CS1
InChIInChI=1S/C8H15NS/c1-3-9-7-8(2)5-4-6-10-8/h4,6,9H,3,5,7H2,1-2H3
InChIKeyAMMGYILKDPAOGM-UHFFFAOYSA-N
XLogP2.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.28
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine
CID 57000948
2-methyl-N-[(2-methyl-3H-thiophen-2-yl)methyl]propan-1-amine
CID 57186297
N-[(2-methyl-3H-thiophen-2-yl)methyl]propan-2-amine
CID 57284310
N-(3-methylsulfanylpropyl)but-3-en-1-amine
CID 57591259
N-(3-methylsulfanylpropyl)pent-4-en-1-amine
CID 64315148
(2R)-N-(2,3-dihydrothiophen-3-ylmethyl)butan-2-amine
CID 66612967
1-(2,3-dihydrothiophen-3-yl)-N-methylethanamine
CID 89068660
2-(2,3-dihydrothiophen-2-yl)-N-methylethanamine
CID 89143500
1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine
CID 89258846
(Z)-5-(ethylamino)-4-methylpent-1-ene-1-thiol
CID 89583688
3-ethenylsulfanyl-2-ethyl-N-methylbut-3-en-1-amine
CID 123829902
2-ethyl-N-methyl-3-methylsulfanylbut-3-en-1-amine
CID 124011774

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine?
The IUPAC name of N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine (CID 57261495) is N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine?
The canonical SMILES for N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine is CCNCC1(C)CC=CS1.
What is the InChIKey of N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine?
The InChIKey is AMMGYILKDPAOGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NS/c1-3-9-7-8(2)5-4-6-10-8/h4,6,9H,3,5,7H2,1-2H3.
What are the key properties of N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine?
N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine has a molecular weight of 157.28 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine is sourced from PubChem (CID 57261495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).