3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide

C15H24N2O2 — CID 55121106

IUPAC3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide
SMILESCCNC(C)CC(=O)N(C)Cc1ccccc1OC
InChIInChI=1S/C15H24N2O2/c1-5-16-12(2)10-15(18)17(3)11-13-8-6-7-9-14(13)19-4/h6-9,12,16H,5,10-11H2,1-4H3
InChIKeyYVXUYYJJJZNXRK-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.04
Rot. Bonds7

About 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide

3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide (PubChem CID 55121106) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide.

Molecular Properties

Compound Name3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide
PubChem CID55121106
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide
SMILESCCNC(C)CC(=O)N(C)Cc1ccccc1OC
InChIInChI=1S/C15H24N2O2/c1-5-16-12(2)10-15(18)17(3)11-13-8-6-7-9-14(13)19-4/h6-9,12,16H,5,10-11H2,1-4H3
InChIKeyYVXUYYJJJZNXRK-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 60630949
N-[(3,4-dimethoxyphenyl)methyl]-3-(ethylamino)-N-methylbutanamide
CID 62837059
3-[(2-methoxyphenyl)methyl-methylamino]-3-oxopropanoic acid
CID 62232246
2-amino-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 60718962
N-[(2,4-difluorophenyl)methyl]-3-(ethylamino)-N-methylbutanamide
CID 62837784
3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N,2-dimethylpropanamide
CID 62852033
N-[(2R)-2-(ethylamino)propyl]-2-(2-methoxyphenyl)acetamide
CID 120652529
3-[[2-[(2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]-methylamino]propanoic acid
CID 119911597
(2R)-2-(2-ethylphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 92672742
1,1-diethyl-3-[(2-methoxyphenyl)methyl]-3-methylurea
CID 113233571
3-(ethylamino)-N-methyl-N-[(4-propan-2-ylphenyl)methyl]butanamide
CID 62838320
2-N-ethyl-4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N-methylpentane-2,4-diamine
CID 65487789

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide?
The IUPAC name of 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide (CID 55121106) is 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide.
What is the SMILES notation for 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide?
The canonical SMILES for 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide is CCNC(C)CC(=O)N(C)Cc1ccccc1OC.
What is the InChIKey of 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide?
The InChIKey is YVXUYYJJJZNXRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-16-12(2)10-15(18)17(3)11-13-8-6-7-9-14(13)19-4/h6-9,12,16H,5,10-11H2,1-4H3.
What are the key properties of 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide?
3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide has a molecular weight of 264.37 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide is sourced from PubChem (CID 55121106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).