N-(2-thiophen-2-ylethyl)cyclopropanamine

C9H13NS — CID 43163847

IUPACN-(2-thiophen-2-ylethyl)cyclopropanamine
SMILESc1csc(CCNC2CC2)c1
InChIInChI=1S/C9H13NS/c1-2-9(11-7-1)5-6-10-8-3-4-8/h1-2,7-8,10H,3-6H2
InChIKeyNXUHRMPTEYCZCD-UHFFFAOYSA-N
MW167.28 g/mol
LogP2.04
Rot. Bonds4

About N-(2-thiophen-2-ylethyl)cyclopropanamine

N-(2-thiophen-2-ylethyl)cyclopropanamine (PubChem CID 43163847) has the molecular formula C9H13NS and a molecular weight of 167.28 g/mol. Its IUPAC name is N-(2-thiophen-2-ylethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2-thiophen-2-ylethyl)cyclopropanamine
PubChem CID43163847
Molecular FormulaC9H13NS
Molecular Weight167.28 g/mol
Exact Mass167.08
IUPAC NameN-(2-thiophen-2-ylethyl)cyclopropanamine
SMILESc1csc(CCNC2CC2)c1
InChIInChI=1S/C9H13NS/c1-2-9(11-7-1)5-6-10-8-3-4-8/h1-2,7-8,10H,3-6H2
InChIKeyNXUHRMPTEYCZCD-UHFFFAOYSA-N
XLogP2.04
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.28
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Methiopropamine
CID 436156
Thiopheneethanamine
CID 116521
1-(Thiophen-2-yl)propan-2-amine hydrochloride
CID 12280954
Methiopropamine (N-methyl-1-(thiophen-2-yl)propan-2-amine)
CID 458582
1-(2-Thienyl)-1-aminoethane
CID 238233
N-Methyl-1-(thiophen-2-yl)methanamine
CID 436153
1-(Thiophen-2-yl)ethan-1-amine hydrochloride
CID 458573
(Prop-2-en-1-yl)(thiophen-2-ylmethyl)amine
CID 2560646
Ethyl[(thiophen-2-yl)methyl]amine
CID 4716479
2-(Thiophen-2-yl)pyrrolidine
CID 339554
3-(Thiophen-2-yl)propan-1-amine
CID 40835
Dipropyl-((1S,2S)-2-thiophen-2-yl-cyclopropyl)-amine
CID 10609150

Frequently Asked Questions

What is the IUPAC name of N-(2-thiophen-2-ylethyl)cyclopropanamine?
The IUPAC name of N-(2-thiophen-2-ylethyl)cyclopropanamine (CID 43163847) is N-(2-thiophen-2-ylethyl)cyclopropanamine.
What is the SMILES notation for N-(2-thiophen-2-ylethyl)cyclopropanamine?
The canonical SMILES for N-(2-thiophen-2-ylethyl)cyclopropanamine is c1csc(CCNC2CC2)c1.
What is the InChIKey of N-(2-thiophen-2-ylethyl)cyclopropanamine?
The InChIKey is NXUHRMPTEYCZCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NS/c1-2-9(11-7-1)5-6-10-8-3-4-8/h1-2,7-8,10H,3-6H2.
What are the key properties of N-(2-thiophen-2-ylethyl)cyclopropanamine?
N-(2-thiophen-2-ylethyl)cyclopropanamine has a molecular weight of 167.28 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-thiophen-2-ylethyl)cyclopropanamine is sourced from PubChem (CID 43163847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).