N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine

C14H20N4O — CID 105167171

IUPACN-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine
SMILESCCNC(Cc1nccn1C)c1cccnc1OC
InChIInChI=1S/C14H20N4O/c1-4-15-12(10-13-16-8-9-18(13)2)11-6-5-7-17-14(11)19-3/h5-9,12,15H,4,10H2,1-3H3
InChIKeyQFQDSCZPROCYIE-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.72
Rot. Bonds6

About N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine

N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine (PubChem CID 105167171) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine
PubChem CID105167171
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine
SMILESCCNC(Cc1nccn1C)c1cccnc1OC
InChIInChI=1S/C14H20N4O/c1-4-15-12(10-13-16-8-9-18(13)2)11-6-5-7-17-14(11)19-3/h5-9,12,15H,4,10H2,1-3H3
InChIKeyQFQDSCZPROCYIE-UHFFFAOYSA-N
XLogP1.72
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine?
The IUPAC name of N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine (CID 105167171) is N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine is CCNC(Cc1nccn1C)c1cccnc1OC.
What is the InChIKey of N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine?
The InChIKey is QFQDSCZPROCYIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-4-15-12(10-13-16-8-9-18(13)2)11-6-5-7-17-14(11)19-3/h5-9,12,15H,4,10H2,1-3H3.
What are the key properties of N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine?
N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine has a molecular weight of 260.34 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine is sourced from PubChem (CID 105167171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).