N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine

C10H17NO — CID 130615257

IUPACN-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine
SMILESCCN(C)C(C)c1ccc(C)o1
InChIInChI=1S/C10H17NO/c1-5-11(4)9(3)10-7-6-8(2)12-10/h6-7,9H,5H2,1-4H3
InChIKeyANSRJCHOURBDNW-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.60
Rot. Bonds3

About N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine

N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine (PubChem CID 130615257) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine
PubChem CID130615257
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC NameN-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine
SMILESCCN(C)C(C)c1ccc(C)o1
InChIInChI=1S/C10H17NO/c1-5-11(4)9(3)10-7-6-8(2)12-10/h6-7,9H,5H2,1-4H3
InChIKeyANSRJCHOURBDNW-UHFFFAOYSA-N
XLogP2.60
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine?
The IUPAC name of N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine (CID 130615257) is N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine?
The canonical SMILES for N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine is CCN(C)C(C)c1ccc(C)o1.
What is the InChIKey of N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine?
The InChIKey is ANSRJCHOURBDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-5-11(4)9(3)10-7-6-8(2)12-10/h6-7,9H,5H2,1-4H3.
What are the key properties of N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine?
N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine has a molecular weight of 167.25 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine is sourced from PubChem (CID 130615257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).