3-(3-methoxythiophen-2-yl)propan-1-amine

C8H13NOS — CID 170868166

IUPAC3-(3-methoxythiophen-2-yl)propan-1-amine
SMILESCOc1ccsc1CCCN
InChIInChI=1S/C8H13NOS/c1-10-7-4-6-11-8(7)3-2-5-9/h4,6H,2-3,5,9H2,1H3
InChIKeyMKPYMATZWXKSJP-UHFFFAOYSA-N
MW171.27 g/mol
LogP1.65
Rot. Bonds4

About 3-(3-methoxythiophen-2-yl)propan-1-amine

3-(3-methoxythiophen-2-yl)propan-1-amine (PubChem CID 170868166) has the molecular formula C8H13NOS and a molecular weight of 171.27 g/mol. Its IUPAC name is 3-(3-methoxythiophen-2-yl)propan-1-amine.

Molecular Properties

Compound Name3-(3-methoxythiophen-2-yl)propan-1-amine
PubChem CID170868166
Molecular FormulaC8H13NOS
Molecular Weight171.27 g/mol
Exact Mass171.07
IUPAC Name3-(3-methoxythiophen-2-yl)propan-1-amine
SMILESCOc1ccsc1CCCN
InChIInChI=1S/C8H13NOS/c1-10-7-4-6-11-8(7)3-2-5-9/h4,6H,2-3,5,9H2,1H3
InChIKeyMKPYMATZWXKSJP-UHFFFAOYSA-N
XLogP1.65
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.27
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-[(3-methoxythiophen-2-yl)methyl]-N'-(2-phenylethyl)ethane-1,2-diamine
CID 120912913
N'-[(3-methoxythiophen-2-yl)methyl]-N'-(2-phenylethyl)ethane-1,2-diamine;hydrochloride
CID 120912912
(2R)-2-N-[(3-methoxythiophen-2-yl)methyl]propane-1,2-diamine
CID 104868109
3-(3-methoxyfuran-2-yl)propan-1-amine
CID 166040043
2-(3-phenoxythiophen-2-yl)ethanamine
CID 170887790
3-(3,4-dimethoxyphenyl)propan-1-amine
CID 2281053
3-methoxy-2-(3-methoxythiophen-2-yl)thiophene
CID 10609306
2-[(3-methoxythiophen-2-yl)methylamino]ethanol
CID 115710462
3-(2-chloro-3,6-dimethoxyphenyl)propan-1-amine
CID 84793335
5-methoxy-N-[(3-methoxythiophen-2-yl)methyl]pentan-1-amine
CID 115710643
2-(5-methoxy-1-benzothiophen-6-yl)ethanamine
CID 96590249
3-(5-fluoro-2-methoxyphenyl)propan-1-amine
CID 55267312

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxythiophen-2-yl)propan-1-amine?
The IUPAC name of 3-(3-methoxythiophen-2-yl)propan-1-amine (CID 170868166) is 3-(3-methoxythiophen-2-yl)propan-1-amine.
What is the SMILES notation for 3-(3-methoxythiophen-2-yl)propan-1-amine?
The canonical SMILES for 3-(3-methoxythiophen-2-yl)propan-1-amine is COc1ccsc1CCCN.
What is the InChIKey of 3-(3-methoxythiophen-2-yl)propan-1-amine?
The InChIKey is MKPYMATZWXKSJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NOS/c1-10-7-4-6-11-8(7)3-2-5-9/h4,6H,2-3,5,9H2,1H3.
What are the key properties of 3-(3-methoxythiophen-2-yl)propan-1-amine?
3-(3-methoxythiophen-2-yl)propan-1-amine has a molecular weight of 171.27 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxythiophen-2-yl)propan-1-amine is sourced from PubChem (CID 170868166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).