N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide

C14H21N3O3 — CID 43083660

IUPACN-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide
SMILESCCNC(=O)NC(=O)C(C)NCc1ccccc1OC
InChIInChI=1S/C14H21N3O3/c1-4-15-14(19)17-13(18)10(2)16-9-11-7-5-6-8-12(11)20-3/h5-8,10,16H,4,9H2,1-3H3,(H2,15,17,18,19)
InChIKeyVWXLVGNNRYSNJN-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.02
Rot. Bonds6

About N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide

N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide (PubChem CID 43083660) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide
PubChem CID43083660
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC NameN-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide
SMILESCCNC(=O)NC(=O)C(C)NCc1ccccc1OC
InChIInChI=1S/C14H21N3O3/c1-4-15-14(19)17-13(18)10(2)16-9-11-7-5-6-8-12(11)20-3/h5-8,10,16H,4,9H2,1-3H3,(H2,15,17,18,19)
InChIKeyVWXLVGNNRYSNJN-UHFFFAOYSA-N
XLogP1.02
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-3-[(2-methoxyphenyl)methyl]urea
CID 38151032
N-cyclopropyl-2-[(2-methoxyphenyl)methylamino]propanamide
CID 43086271
(2S)-N-(ethylcarbamoyl)-2-(2-methoxyphenyl)sulfanylpropanamide
CID 94214626
(2R)-N-ethyl-2-[[2-(2-methoxyphenyl)acetyl]amino]propanamide
CID 8751746
N-ethyl-2-(2-methoxyphenyl)acetamide
CID 3376729
N-[(2R)-2-(ethylamino)propyl]-2-(2-methoxyphenyl)acetamide
CID 120652529
N-(ethylcarbamoyl)-2-[(3-ethyl-2-pyridinyl)methylamino]propanamide
CID 82738463
2-[(5-bromo-2-methoxyphenyl)methylamino]-N-ethylpropanamide
CID 43399003
N-ethyl-2-[(2-hydroxyphenyl)methylamino]propanamide
CID 18546205
1-[(2-methoxyphenyl)methyl]-3-propan-2-ylurea
CID 23548352
N-[(2-methoxyphenyl)methyl]propan-2-amine
CID 11458027
methyl (2S)-2-[(2-propan-2-yloxyphenyl)methylamino]propanoate
CID 43786699

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide?
The IUPAC name of N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide (CID 43083660) is N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide is CCNC(=O)NC(=O)C(C)NCc1ccccc1OC.
What is the InChIKey of N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide?
The InChIKey is VWXLVGNNRYSNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-4-15-14(19)17-13(18)10(2)16-9-11-7-5-6-8-12(11)20-3/h5-8,10,16H,4,9H2,1-3H3,(H2,15,17,18,19).
What are the key properties of N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide?
N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide has a molecular weight of 279.34 g/mol, XLogP of 1.02, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-[(2-methoxyphenyl)methylamino]propanamide is sourced from PubChem (CID 43083660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).