N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide

C8H16F2N2O — CID 103514230

IUPACN-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide
SMILESCN(CC(C)(C)CN)C(=O)C(F)F
InChIInChI=1S/C8H16F2N2O/c1-8(2,4-11)5-12(3)7(13)6(9)10/h6H,4-5,11H2,1-3H3
InChIKeyAMDWEDQRYBULLP-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.69
Rot. Bonds4

About N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide

N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide (PubChem CID 103514230) has the molecular formula C8H16F2N2O and a molecular weight of 194.23 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide
PubChem CID103514230
Molecular FormulaC8H16F2N2O
Molecular Weight194.23 g/mol
Exact Mass194.12
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide
SMILESCN(CC(C)(C)CN)C(=O)C(F)F
InChIInChI=1S/C8H16F2N2O/c1-8(2,4-11)5-12(3)7(13)6(9)10/h6H,4-5,11H2,1-3H3
InChIKeyAMDWEDQRYBULLP-UHFFFAOYSA-N
XLogP0.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-amino-2,2-dimethylpropyl)-1,3,3-trimethylurea
CID 79652129
N-[1-[(3-amino-2,2-dimethylpropyl)-methylamino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide
CID 119656130
N-(3-amino-2,2-dimethylpropyl)-N,3-dimethylbutanamide
CID 79652395
N-(3-amino-2,2-dimethylpropyl)-N-methylbut-2-enamide
CID 115278744
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide
CID 114028856
(2R)-N-(3-amino-2,2-dimethylpropyl)-2-(carbamoylamino)-N-methylpentanamide;hydrochloride
CID 119655370
N-(3-amino-2,2-dimethylpropyl)-2-methoxy-N,2-dimethylpropanamide
CID 103021572
N-(3-amino-2,2-dimethylpropyl)-2-(carbamoylamino)-N-methylhexanamide;hydrochloride
CID 119653315
N-(3-amino-2,2-dimethylpropyl)-N,5-dimethylhexanamide
CID 115272569
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-propan-2-yloxyacetamide;hydrochloride
CID 119655780
N-(3-amino-2,2-dimethylpropyl)-2-cyclopentyloxy-N-methylbutanamide
CID 119653436
N-(3-amino-2,2-dimethylpropyl)-2-(diethylamino)-N-methylacetamide
CID 119652831

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide (CID 103514230) is N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide is CN(CC(C)(C)CN)C(=O)C(F)F.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide?
The InChIKey is AMDWEDQRYBULLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2N2O/c1-8(2,4-11)5-12(3)7(13)6(9)10/h6H,4-5,11H2,1-3H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide?
N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide has a molecular weight of 194.23 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-2,2-difluoro-N-methylacetamide is sourced from PubChem (CID 103514230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).