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

C14H23NS — CID 81027535

IUPAC2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine
SMILESCC(C)(C)NCC1CCCC1c1ccsc1
InChIInChI=1S/C14H23NS/c1-14(2,3)15-9-11-5-4-6-13(11)12-7-8-16-10-12/h7-8,10-11,13,15H,4-6,9H2,1-3H3
InChIKeyFJHHXWSNKITOCF-UHFFFAOYSA-N
MW237.41 g/mol
LogP4.02
Rot. Bonds3

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

2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine (PubChem CID 81027535) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is 2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine
PubChem CID81027535
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC Name2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine
SMILESCC(C)(C)NCC1CCCC1c1ccsc1
InChIInChI=1S/C14H23NS/c1-14(2,3)15-9-11-5-4-6-13(11)12-7-8-16-10-12/h7-8,10-11,13,15H,4-6,9H2,1-3H3
InChIKeyFJHHXWSNKITOCF-UHFFFAOYSA-N
XLogP4.02
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine (CID 81027535) is 2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine is CC(C)(C)NCC1CCCC1c1ccsc1.
What is the InChIKey of 2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine?
The InChIKey is FJHHXWSNKITOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-14(2,3)15-9-11-5-4-6-13(11)12-7-8-16-10-12/h7-8,10-11,13,15H,4-6,9H2,1-3H3.
What are the key properties of 2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine?
2-methyl-N-[(2-thiophen-3-ylcyclopentyl)methyl]propan-2-amine has a molecular weight of 237.41 g/mol, XLogP of 4.02, 3 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-ylcyclopentyl)methyl]propan-2-amine is sourced from PubChem (CID 81027535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).