N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine

C15H25NS — CID 65412770

IUPACN-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine
SMILESCCCNC(Cc1cccs1)C1CCC(C)C1
InChIInChI=1S/C15H25NS/c1-3-8-16-15(11-14-5-4-9-17-14)13-7-6-12(2)10-13/h4-5,9,12-13,15-16H,3,6-8,10-11H2,1-2H3
InChIKeyMZWVZTWMUAJNMF-UHFFFAOYSA-N
MW251.44 g/mol
LogP4.09
Rot. Bonds6

About N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine

N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine (PubChem CID 65412770) has the molecular formula C15H25NS and a molecular weight of 251.44 g/mol. Its IUPAC name is N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine
PubChem CID65412770
Molecular FormulaC15H25NS
Molecular Weight251.44 g/mol
Exact Mass251.17
IUPAC NameN-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine
SMILESCCCNC(Cc1cccs1)C1CCC(C)C1
InChIInChI=1S/C15H25NS/c1-3-8-16-15(11-14-5-4-9-17-14)13-7-6-12(2)10-13/h4-5,9,12-13,15-16H,3,6-8,10-11H2,1-2H3
InChIKeyMZWVZTWMUAJNMF-UHFFFAOYSA-N
XLogP4.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.44
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-propan-2-ylcyclohexyl)-2-thiophen-2-ylethyl]propan-1-amine
CID 65424402
N-(1-cyclopentyl-2-thiophen-2-ylethyl)propan-1-amine
CID 61064990
N-(1-cyclohexyl-2-thiophen-2-ylethyl)propan-1-amine
CID 61066233
N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine
CID 65412104
1-cyclopentyl-N-ethyl-2-thiophen-2-ylethanamine
CID 61065338
[1-(3-ethylcyclopentyl)-2-thiophen-2-ylethyl]hydrazine
CID 105233652
N-[2-(furan-2-yl)-1-(3-methylcyclohexyl)ethyl]propan-1-amine
CID 83175112
N-propyl-1-thiophen-2-ylpropan-2-amine
CID 43692824
1-(4,4-dimethylcyclohexyl)-N-ethyl-2-thiophen-2-ylethanamine
CID 65389654
N-[2-(2,4-difluorophenyl)-1-(3-methylcyclopentyl)ethyl]propan-1-amine
CID 65414201
N-(1-cyclopropyl-2-thiophen-2-ylsulfinylethyl)propan-1-amine
CID 64650951
1-cyclopropyl-1-methoxy-N-propyl-4-thiophen-2-ylbutan-2-amine
CID 116722695

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine?
The IUPAC name of N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine (CID 65412770) is N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine.
What is the SMILES notation for N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine?
The canonical SMILES for N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine is CCCNC(Cc1cccs1)C1CCC(C)C1.
What is the InChIKey of N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine?
The InChIKey is MZWVZTWMUAJNMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NS/c1-3-8-16-15(11-14-5-4-9-17-14)13-7-6-12(2)10-13/h4-5,9,12-13,15-16H,3,6-8,10-11H2,1-2H3.
What are the key properties of N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine?
N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine has a molecular weight of 251.44 g/mol, XLogP of 4.09, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine is sourced from PubChem (CID 65412770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).