N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine

C11H19NOS — CID 51081592

IUPACN-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine
SMILESCCCN(CCOC)Cc1cccs1
InChIInChI=1S/C11H19NOS/c1-3-6-12(7-8-13-2)10-11-5-4-9-14-11/h4-5,9H,3,6-8,10H2,1-2H3
InChIKeyOUGHMYJFBRBHQD-UHFFFAOYSA-N
MW213.35 g/mol
LogP2.61
Rot. Bonds7

About N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine

N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine (PubChem CID 51081592) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine
PubChem CID51081592
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC NameN-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine
SMILESCCCN(CCOC)Cc1cccs1
InChIInChI=1S/C11H19NOS/c1-3-6-12(7-8-13-2)10-11-5-4-9-14-11/h4-5,9H,3,6-8,10H2,1-2H3
InChIKeyOUGHMYJFBRBHQD-UHFFFAOYSA-N
XLogP2.61
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine?
The IUPAC name of N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine (CID 51081592) is N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine is CCCN(CCOC)Cc1cccs1.
What is the InChIKey of N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine?
The InChIKey is OUGHMYJFBRBHQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-3-6-12(7-8-13-2)10-11-5-4-9-14-11/h4-5,9H,3,6-8,10H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine?
N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine has a molecular weight of 213.35 g/mol, XLogP of 2.61, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)propan-1-amine is sourced from PubChem (CID 51081592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).