2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide

C8H17N3O3 — CID 81089472

IUPAC2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide
SMILESCOCC(N)C(=O)NC(C)(C)C(N)=O
InChIInChI=1S/C8H17N3O3/c1-8(2,7(10)13)11-6(12)5(9)4-14-3/h5H,4,9H2,1-3H3,(H2,10,13)(H,11,12)
InChIKeyICDMXGCAYVLUJL-UHFFFAOYSA-N
MW203.24 g/mol
LogP-1.66
Rot. Bonds5

About 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide

2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide (PubChem CID 81089472) has the molecular formula C8H17N3O3 and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide
PubChem CID81089472
Molecular FormulaC8H17N3O3
Molecular Weight203.24 g/mol
Exact Mass203.13
IUPAC Name2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide
SMILESCOCC(N)C(=O)NC(C)(C)C(N)=O
InChIInChI=1S/C8H17N3O3/c1-8(2,7(10)13)11-6(12)5(9)4-14-3/h5H,4,9H2,1-3H3,(H2,10,13)(H,11,12)
InChIKeyICDMXGCAYVLUJL-UHFFFAOYSA-N
XLogP-1.66
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 5-1.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-tert-butyl-3-methoxypropanamide
CID 164800240
2-amino-3-methoxy-N-(3-methylpentan-3-yl)propanamide
CID 106328510
methyl 2-[(2-amino-4-methoxybutanoyl)amino]-2-methylpropanoate
CID 62474644
2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide
CID 81101223
(2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide
CID 79013078
methyl (2S)-2-amino-3-methoxypropanoate
CID 11182627
2-amino-N-(4-tert-butylphenyl)-3-methoxypropanamide
CID 81081326
2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide
CID 115360310
2-amino-3-methoxy-N-(1-methoxypropan-2-yl)propanamide
CID 81082109
N-(1-amino-2-methyl-1-oxopropan-2-yl)-2,4-dimethylpentanamide
CID 163254959
(2R)-5-amino-2-[(2-amino-3-methoxypropanoyl)amino]-5-oxopentanoic acid
CID 107830338
2-amino-3-methoxy-N-(3-methoxy-2-methylpropyl)propanamide
CID 81089502

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide?
The IUPAC name of 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide (CID 81089472) is 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide.
What is the SMILES notation for 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide?
The canonical SMILES for 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide is COCC(N)C(=O)NC(C)(C)C(N)=O.
What is the InChIKey of 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide?
The InChIKey is ICDMXGCAYVLUJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3/c1-8(2,7(10)13)11-6(12)5(9)4-14-3/h5H,4,9H2,1-3H3,(H2,10,13)(H,11,12).
What are the key properties of 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide?
2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide has a molecular weight of 203.24 g/mol, XLogP of -1.66, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide is sourced from PubChem (CID 81089472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).