1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine

C9H12ClNS — CID 130679836

IUPAC1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine
SMILESCNCC1CC1c1ccsc1Cl
InChIInChI=1S/C9H12ClNS/c1-11-5-6-4-8(6)7-2-3-12-9(7)10/h2-3,6,8,11H,4-5H2,1H3
InChIKeyOGFXIFXPHQDVIV-UHFFFAOYSA-N
MW201.72 g/mol
LogP2.72
Rot. Bonds3

About 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine

1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine (PubChem CID 130679836) has the molecular formula C9H12ClNS and a molecular weight of 201.72 g/mol. Its IUPAC name is 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine
PubChem CID130679836
Molecular FormulaC9H12ClNS
Molecular Weight201.72 g/mol
Exact Mass201.04
IUPAC Name1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine
SMILESCNCC1CC1c1ccsc1Cl
InChIInChI=1S/C9H12ClNS/c1-11-5-6-4-8(6)7-2-3-12-9(7)10/h2-3,6,8,11H,4-5H2,1H3
InChIKeyOGFXIFXPHQDVIV-UHFFFAOYSA-N
XLogP2.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.72
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2-chlorothiophen-3-yl)cyclopropyl]methanamine
CID 131187292
1-[2-(2,5-dichlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine
CID 131026581
1-[2-(5-chloro-2-fluorophenyl)cyclopropyl]-N-methylmethanamine
CID 114860003
1-[2-(3-chloro-2-fluorophenyl)cyclopropyl]-N-methylmethanamine
CID 114488832
N-methyl-1-[(1R,2S)-2-(2-methylphenyl)cyclopropyl]methanamine
CID 94558305
1-[(1S,2S)-2-(2-bromophenyl)cyclopropyl]-N-methylmethanamine
CID 94558414
N-methyl-1-(2-thiophen-3-ylcyclopropyl)methanamine
CID 53275665
1-[2-(2-chlorothiophen-3-yl)cyclopropyl]ethanamine
CID 130631226
1-[(1S,2S)-2-(2,4-difluorophenyl)cyclopropyl]-N-methylmethanamine
CID 94558271
N-methyl-1-[(1S,2R)-2-(4-methylphenyl)cyclopropyl]methanamine
CID 94558306
N-methyl-1-[(1S,2S)-2-(4-methylphenyl)cyclopropyl]methanamine
CID 89010387
N-methyl-1-[(1R,2S)-2-(4-propan-2-ylphenyl)cyclopropyl]methanamine
CID 94558404

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine (CID 130679836) is 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine is CNCC1CC1c1ccsc1Cl.
What is the InChIKey of 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine?
The InChIKey is OGFXIFXPHQDVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClNS/c1-11-5-6-4-8(6)7-2-3-12-9(7)10/h2-3,6,8,11H,4-5H2,1H3.
What are the key properties of 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine?
1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine has a molecular weight of 201.72 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-chlorothiophen-3-yl)cyclopropyl]-N-methylmethanamine is sourced from PubChem (CID 130679836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).