2-(cyclohexen-1-yl)thiophene;N-methylmethanamine

C12H19NS — CID 142891098

IUPAC2-(cyclohexen-1-yl)thiophene;N-methylmethanamine
SMILESC1=C(c2cccs2)CCCC1.CNC
InChIInChI=1S/C10H12S.C2H7N/c1-2-5-9(6-3-1)10-7-4-8-11-10;1-3-2/h4-5,7-8H,1-3,6H2;3H,1-2H3
InChIKeyLRZUNGYEOVOEHQ-UHFFFAOYSA-N
MW209.36 g/mol
LogP3.54
Rot. Bonds1

About 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine

2-(cyclohexen-1-yl)thiophene;N-methylmethanamine (PubChem CID 142891098) has the molecular formula C12H19NS and a molecular weight of 209.36 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)thiophene;N-methylmethanamine
PubChem CID142891098
Molecular FormulaC12H19NS
Molecular Weight209.36 g/mol
Exact Mass209.12
IUPAC Name2-(cyclohexen-1-yl)thiophene;N-methylmethanamine
SMILESC1=C(c2cccs2)CCCC1.CNC
InChIInChI=1S/C10H12S.C2H7N/c1-2-5-9(6-3-1)10-7-4-8-11-10;1-3-2/h4-5,7-8H,1-3,6H2;3H,1-2H3
InChIKeyLRZUNGYEOVOEHQ-UHFFFAOYSA-N
XLogP3.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.36
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(cycloocten-1-yl)-1,2,3,4-tetrahydronaphthalene;N-methylmethanamine;hydrochloride
CID 70142476
1-(cyclodecen-1-yl)cyclodecene
CID 54296371
2,3-di(cyclopenten-1-yl)thiophene
CID 91052749
cyclohexen-1-yl(thiophen-2-yl)methanamine
CID 62078485
2-methyl-4-thiophen-2-yl-1,2,3,6-tetrahydropyridine
CID 69191672
methyl 2-[[4-(cyclopenten-1-yl)-5-(2-methylpropyl)-1,3-thiazol-2-yl]amino]-5-thiophen-2-ylpyridine-3-carboxylate
CID 171646341
2-[(1E)-cyclodecen-1-yl]-1H-pyrrole
CID 173176986
1-(cyclohexen-1-yl)-3-thiophen-2-ylpropan-2-ol
CID 116660106
cyclohepten-1-yl(thiophen-2-yl)methanol
CID 62077908
2-(cyclopenten-1-yl)-N-[(4-fluoro-3-thiophen-2-ylphenyl)methyl]ethanamine
CID 106169126
2-(cyclohexen-1-yl)-N-(2-thiophen-2-ylethyl)ethanamine
CID 63773625
N-[cyclohepten-1-yl(thiophen-2-yl)methyl]propan-1-amine
CID 62080201

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine?
The IUPAC name of 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine (CID 142891098) is 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine.
What is the SMILES notation for 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine?
The canonical SMILES for 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine is C1=C(c2cccs2)CCCC1.CNC.
What is the InChIKey of 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine?
The InChIKey is LRZUNGYEOVOEHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12S.C2H7N/c1-2-5-9(6-3-1)10-7-4-8-11-10;1-3-2/h4-5,7-8H,1-3,6H2;3H,1-2H3.
What are the key properties of 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine?
2-(cyclohexen-1-yl)thiophene;N-methylmethanamine has a molecular weight of 209.36 g/mol, XLogP of 3.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)thiophene;N-methylmethanamine is sourced from PubChem (CID 142891098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).