2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine

C12H19NS — CID 62712093

IUPAC2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine
SMILESCC(C)CNCC1CC1c1ccsc1
InChIInChI=1S/C12H19NS/c1-9(2)6-13-7-11-5-12(11)10-3-4-14-8-10/h3-4,8-9,11-13H,5-7H2,1-2H3
InChIKeyGJCQDNCVRLMNCT-UHFFFAOYSA-N
MW209.36 g/mol
LogP3.10
Rot. Bonds5

About 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine

2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine (PubChem CID 62712093) has the molecular formula C12H19NS and a molecular weight of 209.36 g/mol. Its IUPAC name is 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine
PubChem CID62712093
Molecular FormulaC12H19NS
Molecular Weight209.36 g/mol
Exact Mass209.12
IUPAC Name2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine
SMILESCC(C)CNCC1CC1c1ccsc1
InChIInChI=1S/C12H19NS/c1-9(2)6-13-7-11-5-12(11)10-3-4-14-8-10/h3-4,8-9,11-13H,5-7H2,1-2H3
InChIKeyGJCQDNCVRLMNCT-UHFFFAOYSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S,5R)-1-(3-Thienyl)-3-azabicyclo[3.1.0]hexane
CID 44561253
N,N-dipropyl-2-thiophen-3-ylcyclopropan-1-amine;hydrochloride
CID 45259849
4-(3-Thienyl)piperidine
CID 19847314
rac-(1R,2S)-2-(thiophen-3-yl)cyclopropan-1-amine
CID 28901759
Methyl[1-(thiophen-3-yl)propan-2-yl]amine
CID 61077840
Ethanethiol, 2-((4-(3-thienyl)butyl)amino)-, hydrogen sulfate (ester)
CID 217518
Methyl[1-(thiophen-3-yl)propan-2-yl]amine hydrochloride
CID 73994837
4-(Thiophen-3-yl)piperidine hydrochloride
CID 45073797
2-(Thiophen-3-yl)propan-1-amine
CID 54559053
2-(Thiophen-3-yl)propan-1-amine hydrochloride
CID 67850872
1-methyl-4-(thiophen-3-ylmethyl)-3,6-dihydro-2H-pyridine
CID 14956343
3-(Thiophen-3-yl)piperidine hydrochloride
CID 45073822

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine (CID 62712093) is 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine is CC(C)CNCC1CC1c1ccsc1.
What is the InChIKey of 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine?
The InChIKey is GJCQDNCVRLMNCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NS/c1-9(2)6-13-7-11-5-12(11)10-3-4-14-8-10/h3-4,8-9,11-13H,5-7H2,1-2H3.
What are the key properties of 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine?
2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine has a molecular weight of 209.36 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-thiophen-3-ylcyclopropyl)methyl]propan-1-amine is sourced from PubChem (CID 62712093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).