3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine

C16H26N2O2 — CID 65169554

IUPAC3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine
SMILESCCOC1CC(NCc2ccnc(OC)c2)C1(C)CC
InChIInChI=1S/C16H26N2O2/c1-5-16(3)13(10-14(16)20-6-2)18-11-12-7-8-17-15(9-12)19-4/h7-9,13-14,18H,5-6,10-11H2,1-4H3
InChIKeyHYRWQJGMBMJJBD-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.77
Rot. Bonds7

About 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine

3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine (PubChem CID 65169554) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine.

Molecular Properties

Compound Name3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine
PubChem CID65169554
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine
SMILESCCOC1CC(NCc2ccnc(OC)c2)C1(C)CC
InChIInChI=1S/C16H26N2O2/c1-5-16(3)13(10-14(16)20-6-2)18-11-12-7-8-17-15(9-12)19-4/h7-9,13-14,18H,5-6,10-11H2,1-4H3
InChIKeyHYRWQJGMBMJJBD-UHFFFAOYSA-N
XLogP2.77
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-[[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]methyl]phenyl]methanol
CID 107229736
3-ethoxy-2-ethyl-2-methyl-N-[(1-methylimidazol-2-yl)methyl]cyclobutan-1-amine
CID 65169925
3-ethoxy-2-ethyl-2-methyl-N-(1,3-thiazol-4-ylmethyl)cyclobutan-1-amine
CID 65169503
3-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]cyclobutan-1-amine
CID 104871414
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine
CID 79237350
3-ethoxy-N-[(4-methoxyphenyl)methyl]-2,2-dimethylcyclobutan-1-amine
CID 64687156
3-ethoxy-2-ethyl-2-methyl-N-(2H-tetrazol-5-ylmethyl)cyclobutan-1-amine
CID 65169439
3-ethoxy-2-ethyl-2-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 65170309
2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]cyclopentan-1-amine
CID 113260129
5-N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-2-N,2-N-dimethylpyridine-2,5-diamine
CID 65168199
(2-methoxy-4-pyridinyl)methylazanium
CID 25323729
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-4-methylsulfanylaniline
CID 65170411

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine?
The IUPAC name of 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine (CID 65169554) is 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine.
What is the SMILES notation for 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine?
The canonical SMILES for 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine is CCOC1CC(NCc2ccnc(OC)c2)C1(C)CC.
What is the InChIKey of 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine?
The InChIKey is HYRWQJGMBMJJBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-5-16(3)13(10-14(16)20-6-2)18-11-12-7-8-17-15(9-12)19-4/h7-9,13-14,18H,5-6,10-11H2,1-4H3.
What are the key properties of 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine?
3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine has a molecular weight of 278.40 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]-2-methylcyclobutan-1-amine is sourced from PubChem (CID 65169554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).