N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine

C10H15NS — CID 59461030

IUPACN-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine
SMILESCC(C)NC1CCc2sccc21
InChIInChI=1S/C10H15NS/c1-7(2)11-9-3-4-10-8(9)5-6-12-10/h5-7,9,11H,3-4H2,1-2H3
InChIKeyBCCYCYPQQLSVRI-UHFFFAOYSA-N
MW181.30 g/mol
LogP2.73
Rot. Bonds2

About N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine

N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine (PubChem CID 59461030) has the molecular formula C10H15NS and a molecular weight of 181.30 g/mol. Its IUPAC name is N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine.

Molecular Properties

Compound NameN-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine
PubChem CID59461030
Molecular FormulaC10H15NS
Molecular Weight181.30 g/mol
Exact Mass181.09
IUPAC NameN-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine
SMILESCC(C)NC1CCc2sccc21
InChIInChI=1S/C10H15NS/c1-7(2)11-9-3-4-10-8(9)5-6-12-10/h5-7,9,11H,3-4H2,1-2H3
InChIKeyBCCYCYPQQLSVRI-UHFFFAOYSA-N
XLogP2.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.30
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-cyclopentylethyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 81393881
N-(1-phenylethyl)-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 62842628
2-(4,5,6,7-tetrahydro-1-benzothiophen-4-ylamino)propanamide
CID 62840901
2-[1-(4,5,6,7-tetrahydro-1-benzothiophen-4-ylamino)ethyl]phenol
CID 62841470
N-[(1R)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 81351326
N-[(1S)-1-(2-chlorophenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 81376952
N-[1-(4-fluorophenyl)-2-methylpropyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 62842649
N-[1-(3,4-dimethylphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 62841811
N-(1-thiophen-2-ylpropan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 62842653
(2R)-2-(4,5,6,7-tetrahydro-1-benzothiophen-4-ylamino)butan-1-ol
CID 103922414
ethane;N-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine;molecular hydrogen
CID 143347244
4-[1-(4,5,6,7-tetrahydro-1-benzothiophen-4-ylamino)ethyl]benzonitrile
CID 62842476

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine?
The IUPAC name of N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine (CID 59461030) is N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine.
What is the SMILES notation for N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine?
The canonical SMILES for N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine is CC(C)NC1CCc2sccc21.
What is the InChIKey of N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine?
The InChIKey is BCCYCYPQQLSVRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NS/c1-7(2)11-9-3-4-10-8(9)5-6-12-10/h5-7,9,11H,3-4H2,1-2H3.
What are the key properties of N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine?
N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine has a molecular weight of 181.30 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine is sourced from PubChem (CID 59461030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).