2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide

C14H20N2O3 — CID 34960365

IUPAC2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide
SMILESCOc1ccc(CN(CC(N)=O)C2CC2)c(OC)c1
InChIInChI=1S/C14H20N2O3/c1-18-12-6-3-10(13(7-12)19-2)8-16(9-14(15)17)11-4-5-11/h3,6-7,11H,4-5,8-9H2,1-2H3,(H2,15,17)
InChIKeyAGZUPBCQLGKUPJ-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.15
Rot. Bonds7

About 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide

2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide (PubChem CID 34960365) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide.

Molecular Properties

Compound Name2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide
PubChem CID34960365
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide
SMILESCOc1ccc(CN(CC(N)=O)C2CC2)c(OC)c1
InChIInChI=1S/C14H20N2O3/c1-18-12-6-3-10(13(7-12)19-2)8-16(9-14(15)17)11-4-5-11/h3,6-7,11H,4-5,8-9H2,1-2H3,(H2,15,17)
InChIKeyAGZUPBCQLGKUPJ-UHFFFAOYSA-N
XLogP1.15
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetic acid
CID 39364524
1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]ethanone;methanol
CID 177146084
1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]ethanone;N-methylmethanamine
CID 177146153
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-propan-2-ylacetamide
CID 34979795
1-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]ethanone;azetidine
CID 177146134
1-(azocan-1-yl)-2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]ethanone
CID 134007217
4-N-[(2,4-dimethoxyphenyl)methyl]-4-N-methylcyclohexane-1,4-diamine
CID 79121517
2-[cyclopropyl-[2-(2,4-dimethoxyphenyl)acetyl]amino]acetic acid
CID 60827055
2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide
CID 60513356
2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide
CID 34960796
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(4-methylphenyl)acetamide
CID 34978448
N-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]-2,4-dimethylbenzamide
CID 33032868

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide?
The IUPAC name of 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide (CID 34960365) is 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide.
What is the SMILES notation for 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide?
The canonical SMILES for 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide is COc1ccc(CN(CC(N)=O)C2CC2)c(OC)c1.
What is the InChIKey of 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide?
The InChIKey is AGZUPBCQLGKUPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-18-12-6-3-10(13(7-12)19-2)8-16(9-14(15)17)11-4-5-11/h3,6-7,11H,4-5,8-9H2,1-2H3,(H2,15,17).
What are the key properties of 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide?
2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide has a molecular weight of 264.32 g/mol, XLogP of 1.15, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetamide is sourced from PubChem (CID 34960365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).