5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine

C11H19NOS — CID 103631875

IUPAC5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine
SMILESCOCCCCCNCc1ccsc1
InChIInChI=1S/C11H19NOS/c1-13-7-4-2-3-6-12-9-11-5-8-14-10-11/h5,8,10,12H,2-4,6-7,9H2,1H3
InChIKeyFZTSBCWQSHUCTM-UHFFFAOYSA-N
MW213.35 g/mol
LogP2.65
Rot. Bonds8

About 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine

5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine (PubChem CID 103631875) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine.

Molecular Properties

Compound Name5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine
PubChem CID103631875
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC Name5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine
SMILESCOCCCCCNCc1ccsc1
InChIInChI=1S/C11H19NOS/c1-13-7-4-2-3-6-12-9-11-5-8-14-10-11/h5,8,10,12H,2-4,6-7,9H2,1H3
InChIKeyFZTSBCWQSHUCTM-UHFFFAOYSA-N
XLogP2.65
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-iodo-N-(thiophen-3-ylmethyl)pentan-1-amine
CID 107320001
N-(thiophen-3-ylmethyl)butan-1-amine;hydrochloride
CID 17332318
4,4-dimethyl-N-(thiophen-3-ylmethyl)pentan-1-amine
CID 115642825
3-cyclopentyloxy-N-(thiophen-3-ylmethyl)propan-1-amine;hydrochloride
CID 115598283
3-cyclohexyloxy-N-(thiophen-3-ylmethyl)propan-1-amine
CID 28720110
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-1-thiophen-3-ylmethanamine
CID 115735920
5-methoxy-N-[(3-methoxythiophen-2-yl)methyl]pentan-1-amine
CID 115710643
N-[(3-fluoro-4-methylphenyl)methyl]-5-methoxypentan-1-amine
CID 103654079
N-[3-(thiophen-3-ylmethylamino)propyl]ethanesulfonamide
CID 115598596
N-[(3-bromo-4-methylphenyl)methyl]-5-methoxypentan-1-amine
CID 103880524
N-(thiophen-3-ylmethyl)-N',N'-bis[2-(thiophen-3-ylmethylamino)ethyl]ethane-1,2-diamine
CID 100933177
1-[4-(2-methoxyethoxy)butyl]-2-methyl-3-(thiophen-3-ylmethyl)guanidine;hydroiodide
CID 111941414

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine?
The IUPAC name of 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine (CID 103631875) is 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine.
What is the SMILES notation for 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine?
The canonical SMILES for 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine is COCCCCCNCc1ccsc1.
What is the InChIKey of 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine?
The InChIKey is FZTSBCWQSHUCTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-13-7-4-2-3-6-12-9-11-5-8-14-10-11/h5,8,10,12H,2-4,6-7,9H2,1H3.
What are the key properties of 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine?
5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine has a molecular weight of 213.35 g/mol, XLogP of 2.65, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-(thiophen-3-ylmethyl)pentan-1-amine is sourced from PubChem (CID 103631875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).