2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine

C17H30N2O2 — CID 116718083

IUPAC2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
SMILESCCCC(OCC)C(NCC)c1cncc(OC(C)C)c1
InChIInChI=1S/C17H30N2O2/c1-6-9-16(20-8-3)17(19-7-2)14-10-15(12-18-11-14)21-13(4)5/h10-13,16-17,19H,6-9H2,1-5H3
InChIKeyZWLLZUPVCODGMV-UHFFFAOYSA-N
MW294.44 g/mol
LogP3.72
Rot. Bonds10

About 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine

2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine (PubChem CID 116718083) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine.

Molecular Properties

Compound Name2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
PubChem CID116718083
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
SMILESCCCC(OCC)C(NCC)c1cncc(OC(C)C)c1
InChIInChI=1S/C17H30N2O2/c1-6-9-16(20-8-3)17(19-7-2)14-10-15(12-18-11-14)21-13(4)5/h10-13,16-17,19H,6-9H2,1-5H3
InChIKeyZWLLZUPVCODGMV-UHFFFAOYSA-N
XLogP3.72
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-1-(5-ethoxy-3-pyridinyl)-N-ethylpentan-1-amine
CID 116717966
N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)hexan-1-amine
CID 105027344
3-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)propan-1-amine
CID 105176221
2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
CID 116718601
N-ethyl-2-[(2-methylpropan-2-yl)oxy]-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine
CID 105176094
2-methoxy-3-methyl-1-(5-propan-2-yloxy-3-pyridinyl)-N-propylbutan-1-amine
CID 116720620
[2-ethoxy-1-(3-propan-2-yloxyphenyl)pentyl]hydrazine
CID 105271449
[2-ethoxy-1-(4-propan-2-yloxyphenyl)pentyl]hydrazine
CID 105271540
1-(4-cyclopropyloxyphenyl)-2-ethoxy-N-ethylpentan-1-amine
CID 114519795
2-ethoxy-3,3-dimethyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-amine
CID 116725313
2-ethoxy-N-ethyl-3-methyl-1-(5-methyl-3-pyridinyl)butan-1-amine
CID 116721522
N-[(1-methoxycyclobutyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 116714615

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine?
The IUPAC name of 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine (CID 116718083) is 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine.
What is the SMILES notation for 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine?
The canonical SMILES for 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine is CCCC(OCC)C(NCC)c1cncc(OC(C)C)c1.
What is the InChIKey of 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine?
The InChIKey is ZWLLZUPVCODGMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-6-9-16(20-8-3)17(19-7-2)14-10-15(12-18-11-14)21-13(4)5/h10-13,16-17,19H,6-9H2,1-5H3.
What are the key properties of 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine?
2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine has a molecular weight of 294.44 g/mol, XLogP of 3.72, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine is sourced from PubChem (CID 116718083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).