2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide

C8H18N2O3 — CID 81101223

IUPAC2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCC(C)(C)O
InChIInChI=1S/C8H18N2O3/c1-8(2,12)5-10-7(11)6(9)4-13-3/h6,12H,4-5,9H2,1-3H3,(H,10,11)
InChIKeyATEBMWAJAICIAX-UHFFFAOYSA-N
MW190.24 g/mol
LogP-1.15
Rot. Bonds5

About 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide

2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide (PubChem CID 81101223) has the molecular formula C8H18N2O3 and a molecular weight of 190.24 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide
PubChem CID81101223
Molecular FormulaC8H18N2O3
Molecular Weight190.24 g/mol
Exact Mass190.13
IUPAC Name2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCC(C)(C)O
InChIInChI=1S/C8H18N2O3/c1-8(2,12)5-10-7(11)6(9)4-13-3/h6,12H,4-5,9H2,1-3H3,(H,10,11)
InChIKeyATEBMWAJAICIAX-UHFFFAOYSA-N
XLogP-1.15
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 5-1.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide
CID 115360310
2-amino-N-(2-hydroxy-2-methylpropyl)-4-methylpentanamide
CID 65107509
(2S)-2-amino-N-tert-butyl-3-methoxypropanamide
CID 164800240
4-amino-5-[(2-hydroxy-2-methylpropyl)amino]-5-oxopentanoic acid
CID 65106502
2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-3-methoxypropanamide;hydrochloride
CID 120986999
2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide
CID 81088978
2-amino-3-methoxy-N-(3-methoxy-2-methylpropyl)propanamide
CID 81089502
2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide
CID 81089472
2-amino-N-(2-hydroxy-4-methoxy-2-methylbutyl)butanamide
CID 106254850
2-amino-3-methoxy-N-(2-methyl-2-thiophen-2-ylpropyl)propanamide;hydrochloride
CID 120989918
2-amino-3-methoxy-N-(3-methylpentan-3-yl)propanamide
CID 106328510
2-amino-3-methoxy-N-(2-methylprop-2-enyl)propanamide
CID 114617067

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide?
The IUPAC name of 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide (CID 81101223) is 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide is COCC(N)C(=O)NCC(C)(C)O.
What is the InChIKey of 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide?
The InChIKey is ATEBMWAJAICIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3/c1-8(2,12)5-10-7(11)6(9)4-13-3/h6,12H,4-5,9H2,1-3H3,(H,10,11).
What are the key properties of 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide?
2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide has a molecular weight of 190.24 g/mol, XLogP of -1.15, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide is sourced from PubChem (CID 81101223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).