N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

C10H20F2N2O2 — CID 107493239

IUPACN-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)N(CCN)CC(F)F
InChIInChI=1S/C10H20F2N2O2/c1-10(2,3)16-7-9(15)14(5-4-13)6-8(11)12/h8H,4-7,13H2,1-3H3
InChIKeyMYZYBBCYQUASCX-UHFFFAOYSA-N
MW238.28 g/mol
LogP0.85
Rot. Bonds6

About N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 107493239) has the molecular formula C10H20F2N2O2 and a molecular weight of 238.28 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID107493239
Molecular FormulaC10H20F2N2O2
Molecular Weight238.28 g/mol
Exact Mass238.15
IUPAC NameN-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)N(CCN)CC(F)F
InChIInChI=1S/C10H20F2N2O2/c1-10(2,3)16-7-9(15)14(5-4-13)6-8(11)12/h8H,4-7,13H2,1-3H3
InChIKeyMYZYBBCYQUASCX-UHFFFAOYSA-N
XLogP0.85
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.28
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-(4-methoxyphenyl)acetamide
CID 107493334
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-methoxypropanamide
CID 107493240
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide
CID 107483272
N,N-dimethyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 12636379
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-5-methylfuran-2-carboxamide
CID 107493288
N-(3-amino-3-sulfanylidenepropyl)-N-ethyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112602684
N-cyclopropyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604340
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-1-methylcyclopentane-1-carboxamide
CID 107493421
2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide
CID 112604821
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-ethoxybenzamide
CID 107493431
2-[2-aminoethyl(2,2-difluoroethyl)amino]-N,N-diethylacetamide
CID 107494429
tert-butyl N-(2-aminoethyl)-N-[(2S)-2-hydroxypropyl]carbamate
CID 97184684

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 107493239) is N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide is CC(C)(C)OCC(=O)N(CCN)CC(F)F.
What is the InChIKey of N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is MYZYBBCYQUASCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F2N2O2/c1-10(2,3)16-7-9(15)14(5-4-13)6-8(11)12/h8H,4-7,13H2,1-3H3.
What are the key properties of N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 238.28 g/mol, XLogP of 0.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 107493239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).