2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid

C15H22N2O4 — CID 62820544

IUPAC2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid
SMILESCCN(C(=O)NCc1ccccc1OC)C(C)(C)C(=O)O
InChIInChI=1S/C15H22N2O4/c1-5-17(15(2,3)13(18)19)14(20)16-10-11-8-6-7-9-12(11)21-4/h6-9H,5,10H2,1-4H3,(H,16,20)(H,18,19)
InChIKeyPXBVJFMLGPPSKC-UHFFFAOYSA-N
MW294.35 g/mol
LogP2.09
Rot. Bonds6

About 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid

2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid (PubChem CID 62820544) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid.

Molecular Properties

Compound Name2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid
PubChem CID62820544
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid
SMILESCCN(C(=O)NCc1ccccc1OC)C(C)(C)C(=O)O
InChIInChI=1S/C15H22N2O4/c1-5-17(15(2,3)13(18)19)14(20)16-10-11-8-6-7-9-12(11)21-4/h6-9H,5,10H2,1-4H3,(H,16,20)(H,18,19)
InChIKeyPXBVJFMLGPPSKC-UHFFFAOYSA-N
XLogP2.09
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[ethyl-[(4-fluoro-2-methoxyphenyl)carbamoyl]amino]-2-methylpropanoic acid
CID 62822555
1-ethyl-3-[(2-methoxyphenyl)methyl]urea
CID 38151032
2-[(2-methoxyphenyl)methylcarbamoyl-propan-2-ylamino]acetic acid
CID 61181869
2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 78963113
N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 62834293
tert-butyl N-[(2-methoxyphenyl)methyl]carbamate;hydrochloride
CID 174676513
1-benzyl-3-[(2-methoxyphenyl)methyl]-1-propan-2-ylurea
CID 108897327
2-[ethyl-[3-(2-methoxyphenyl)prop-2-enoyl]amino]-2-methylpropanoic acid
CID 76949869
1-[(1R)-1-cyclopropylethyl]-3-[(2-methoxyphenyl)methyl]-1-methylurea
CID 38272161
2-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methyl-3-phenylbutanamide
CID 122144681
4-tert-butyl-N-[(2-methoxyphenyl)methyl]benzamide
CID 795553
2-anilino-N-[(2-methoxyphenyl)methyl]acetamide
CID 60646954

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid?
The IUPAC name of 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid (CID 62820544) is 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid.
What is the SMILES notation for 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid?
The canonical SMILES for 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid is CCN(C(=O)NCc1ccccc1OC)C(C)(C)C(=O)O.
What is the InChIKey of 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid?
The InChIKey is PXBVJFMLGPPSKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-5-17(15(2,3)13(18)19)14(20)16-10-11-8-6-7-9-12(11)21-4/h6-9H,5,10H2,1-4H3,(H,16,20)(H,18,19).
What are the key properties of 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid?
2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid has a molecular weight of 294.35 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[(2-methoxyphenyl)methylcarbamoyl]amino]-2-methylpropanoic acid is sourced from PubChem (CID 62820544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).