2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide

C9H20N2O3 — CID 115360310

IUPAC2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCC(C)(C)CO
InChIInChI=1S/C9H20N2O3/c1-9(2,6-12)5-11-8(13)7(10)4-14-3/h7,12H,4-6,10H2,1-3H3,(H,11,13)
InChIKeyRXJOPKKGNHBVDB-UHFFFAOYSA-N
MW204.27 g/mol
LogP-0.91
Rot. Bonds6

About 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide

2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide (PubChem CID 115360310) has the molecular formula C9H20N2O3 and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide
PubChem CID115360310
Molecular FormulaC9H20N2O3
Molecular Weight204.27 g/mol
Exact Mass204.15
IUPAC Name2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCC(C)(C)CO
InChIInChI=1S/C9H20N2O3/c1-9(2,6-12)5-11-8(13)7(10)4-14-3/h7,12H,4-6,10H2,1-3H3,(H,11,13)
InChIKeyRXJOPKKGNHBVDB-UHFFFAOYSA-N
XLogP-0.91
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxypropanamide
CID 81101223
(2S)-2-amino-N-(3-hydroxy-2,2-dimethylpropyl)propanamide
CID 115360252
(2S)-2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3,3-dimethylbutanamide
CID 115360318
2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-3-methoxypropanamide;hydrochloride
CID 120986999
(2S)-2-amino-N-tert-butyl-3-methoxypropanamide
CID 164800240
2-amino-N-(5-hydroxy-2,2-dimethylpentyl)-5-methoxypentanamide
CID 106148113
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide
CID 81089376
2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]-4-methoxybutanamide
CID 62474428
2,2-difluoro-N-(3-hydroxy-2,2-dimethylpropyl)acetamide
CID 103513975
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

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide?
The IUPAC name of 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide (CID 115360310) is 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide is COCC(N)C(=O)NCC(C)(C)CO.
What is the InChIKey of 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide?
The InChIKey is RXJOPKKGNHBVDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3/c1-9(2,6-12)5-11-8(13)7(10)4-14-3/h7,12H,4-6,10H2,1-3H3,(H,11,13).
What are the key properties of 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide?
2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide has a molecular weight of 204.27 g/mol, XLogP of -0.91, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-hydroxy-2,2-dimethylpropyl)-3-methoxypropanamide is sourced from PubChem (CID 115360310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).