1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine

C14H23NO2 — CID 103775921

IUPAC1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine
SMILESCCC(COC)NCCc1ccccc1OC
InChIInChI=1S/C14H23NO2/c1-4-13(11-16-2)15-10-9-12-7-5-6-8-14(12)17-3/h5-8,13,15H,4,9-11H2,1-3H3
InChIKeyIOWVMHIMBYPLPD-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.25
Rot. Bonds8

About 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine

1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine (PubChem CID 103775921) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine.

Molecular Properties

Compound Name1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine
PubChem CID103775921
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine
SMILESCCC(COC)NCCc1ccccc1OC
InChIInChI=1S/C14H23NO2/c1-4-13(11-16-2)15-10-9-12-7-5-6-8-14(12)17-3/h5-8,13,15H,4,9-11H2,1-3H3
InChIKeyIOWVMHIMBYPLPD-UHFFFAOYSA-N
XLogP2.25
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,1-dimethoxy-N-[2-(2-methoxyphenyl)ethyl]propan-2-amine
CID 106259984
3-methoxy-N-[2-(2-methoxyphenyl)ethyl]propan-1-amine
CID 106261296
2-N-[2-(2-methoxyphenyl)ethyl]-3-methylbutane-1,2-diamine
CID 106345493
2-bromo-N-[2-(2-methoxyphenyl)ethyl]butanamide
CID 106260338
4-ethyl-1-(2-methoxyphenyl)-N-propylhexan-2-amine
CID 82922595
N-[2-(2-methoxyphenyl)ethyl]-1-(2-methylphenyl)propan-2-amine
CID 57276686
2-[2-(2-methoxyphenyl)ethylamino]-N-(2-methylpropyl)propanamide
CID 103604200
1-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]propan-2-amine
CID 103775898
1-(3,5-dimethylphenyl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
CID 106259657
(2S)-N-benzyl-1-methoxybutan-2-amine
CID 95366266
1-methoxy-2-[(3R)-3-methylpentyl]benzene
CID 142086575
N'-(2-methoxyethyl)-N-[2-(2-methoxyphenyl)ethyl]oxamide
CID 44996618

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine?
The IUPAC name of 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine (CID 103775921) is 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine.
What is the SMILES notation for 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine?
The canonical SMILES for 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine is CCC(COC)NCCc1ccccc1OC.
What is the InChIKey of 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine?
The InChIKey is IOWVMHIMBYPLPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-4-13(11-16-2)15-10-9-12-7-5-6-8-14(12)17-3/h5-8,13,15H,4,9-11H2,1-3H3.
What are the key properties of 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine?
1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine has a molecular weight of 237.34 g/mol, XLogP of 2.25, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-[2-(2-methoxyphenyl)ethyl]butan-2-amine is sourced from PubChem (CID 103775921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).