N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide

C9H20N2O2 — CID 82723789

IUPACN-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide
SMILESCCCNCC(=O)NOC(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-5-6-10-7-8(12)11-13-9(2,3)4/h10H,5-7H2,1-4H3,(H,11,12)
InChIKeySIVOAODYKXJGMY-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.83
Rot. Bonds5

About N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide

N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide (PubChem CID 82723789) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide.

Molecular Properties

Compound NameN-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide
PubChem CID82723789
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC NameN-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide
SMILESCCCNCC(=O)NOC(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-5-6-10-7-8(12)11-13-9(2,3)4/h10H,5-7H2,1-4H3,(H,11,12)
InChIKeySIVOAODYKXJGMY-UHFFFAOYSA-N
XLogP0.83
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82720220
2-butylsulfanyl-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82724054
N-(2-methylpropoxy)-2-(propylamino)acetamide
CID 82722668
N-methyl-2-(propylamino)acetamide
CID 28586328
N-prop-2-enyl-2-(propylamino)acetamide
CID 54819030
N-(2-methoxy-2-methylpropyl)-2-(propylamino)acetamide
CID 104761261
tert-butyl N-[2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]carbamate
CID 112688730
2-(propylamino)acetamide
CID 15839438
3-amino-3-methyl-N-[(2-methylpropan-2-yl)oxy]butanamide
CID 82724126
2-(propylamino)-N-(2,3,3-trimethylbutyl)acetamide
CID 83143043
N-(3-butoxypropyl)-2-(propylamino)acetamide
CID 115574332
2-(dimethylamino)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82724267

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide?
The IUPAC name of N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide (CID 82723789) is N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide.
What is the SMILES notation for N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide?
The canonical SMILES for N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide is CCCNCC(=O)NOC(C)(C)C.
What is the InChIKey of N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide?
The InChIKey is SIVOAODYKXJGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-5-6-10-7-8(12)11-13-9(2,3)4/h10H,5-7H2,1-4H3,(H,11,12).
What are the key properties of N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide?
N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide has a molecular weight of 188.27 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide is sourced from PubChem (CID 82723789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).