4-methoxy-1-thiophen-3-ylhexan-3-amine

C11H19NOS — CID 116715242

IUPAC4-methoxy-1-thiophen-3-ylhexan-3-amine
SMILESCCC(OC)C(N)CCc1ccsc1
InChIInChI=1S/C11H19NOS/c1-3-11(13-2)10(12)5-4-9-6-7-14-8-9/h6-8,10-11H,3-5,12H2,1-2H3
InChIKeyCTAOLMAXSQGSOV-UHFFFAOYSA-N
MW213.35 g/mol
LogP2.43
Rot. Bonds6

About 4-methoxy-1-thiophen-3-ylhexan-3-amine

4-methoxy-1-thiophen-3-ylhexan-3-amine (PubChem CID 116715242) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is 4-methoxy-1-thiophen-3-ylhexan-3-amine.

Molecular Properties

Compound Name4-methoxy-1-thiophen-3-ylhexan-3-amine
PubChem CID116715242
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC Name4-methoxy-1-thiophen-3-ylhexan-3-amine
SMILESCCC(OC)C(N)CCc1ccsc1
InChIInChI=1S/C11H19NOS/c1-3-11(13-2)10(12)5-4-9-6-7-14-8-9/h6-8,10-11H,3-5,12H2,1-2H3
InChIKeyCTAOLMAXSQGSOV-UHFFFAOYSA-N
XLogP2.43
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-1-methoxy-4-thiophen-3-ylbutan-2-amine
CID 116722043
4-amino-1-thiophen-3-ylheptan-3-ol
CID 83927744
4-ethoxy-N-methyl-1-thiophen-3-ylhexan-3-amine
CID 116716710
1-thiophen-3-ylnonan-3-amine
CID 115857036
3-methoxy-1-thiophen-3-ylbutan-2-amine
CID 79616789
1-(3,4-diethoxyphenyl)-3-thiophen-3-ylpropan-1-amine
CID 115856968
4-propyl-1-thiophen-3-ylheptan-3-ol
CID 115798450
1-propan-2-ylsulfanyl-4-thiophen-3-ylbutan-2-amine
CID 65131707
2-amino-4-thiophen-3-ylbutanoic acid
CID 18951372
5-methyl-1-thiophen-3-ylheptan-3-ol
CID 115798340
1-methoxy-N-methyl-4-thiophen-3-ylbutan-2-amine
CID 62319829
azane;3-propylthiophene
CID 174446539

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-thiophen-3-ylhexan-3-amine?
The IUPAC name of 4-methoxy-1-thiophen-3-ylhexan-3-amine (CID 116715242) is 4-methoxy-1-thiophen-3-ylhexan-3-amine.
What is the SMILES notation for 4-methoxy-1-thiophen-3-ylhexan-3-amine?
The canonical SMILES for 4-methoxy-1-thiophen-3-ylhexan-3-amine is CCC(OC)C(N)CCc1ccsc1.
What is the InChIKey of 4-methoxy-1-thiophen-3-ylhexan-3-amine?
The InChIKey is CTAOLMAXSQGSOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-3-11(13-2)10(12)5-4-9-6-7-14-8-9/h6-8,10-11H,3-5,12H2,1-2H3.
What are the key properties of 4-methoxy-1-thiophen-3-ylhexan-3-amine?
4-methoxy-1-thiophen-3-ylhexan-3-amine has a molecular weight of 213.35 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-thiophen-3-ylhexan-3-amine is sourced from PubChem (CID 116715242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).