3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide

C16H26N2O — CID 115426224

IUPAC3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide
SMILESCC(C)(CN)C(=O)NC(c1ccccc1)C(C)(C)C
InChIInChI=1S/C16H26N2O/c1-15(2,3)13(12-9-7-6-8-10-12)18-14(19)16(4,5)11-17/h6-10,13H,11,17H2,1-5H3,(H,18,19)
InChIKeyFJGRKCLNZUPYSQ-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.87
Rot. Bonds4

About 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide

3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide (PubChem CID 115426224) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide
PubChem CID115426224
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide
SMILESCC(C)(CN)C(=O)NC(c1ccccc1)C(C)(C)C
InChIInChI=1S/C16H26N2O/c1-15(2,3)13(12-9-7-6-8-10-12)18-14(19)16(4,5)11-17/h6-10,13H,11,17H2,1-5H3,(H,18,19)
InChIKeyFJGRKCLNZUPYSQ-UHFFFAOYSA-N
XLogP2.87
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2,2-dimethyl-N-[(1S)-1-phenylethyl]propanamide
CID 115426736
N-[(1S)-2,2-dimethyl-1-phenylpropyl]-2,2,2-trifluoroacetamide
CID 11097278
3-amino-2,2-dimethyl-N-[phenyl(thiophen-2-yl)methyl]propanamide
CID 115426261
N-(2,2-dimethyl-1-phenylpropyl)-2,2,3,3-tetrafluoropropanamide
CID 103733000
N-(2,2-dimethyl-1-phenylpropyl)-2-(methylamino)acetamide
CID 43705369
3-amino-N-(2,2-dimethyl-1-phenylpropyl)butanamide
CID 60836669
N-[(1R)-2,2-dimethyl-1-phenylpropyl]benzamide
CID 51940794
(2S)-2-amino-N-(2,2-dimethyl-1-phenylpropyl)propanamide;hydrochloride
CID 119290104
3-amino-2,2-dimethyl-N-[(1-methylimidazol-2-yl)-phenylmethyl]propanamide
CID 115426635
3-amino-N-[1-(3-chlorophenyl)ethyl]-2,2-dimethylpropanamide;hydrochloride
CID 119685342
5-amino-N-(2,2-dimethyl-1-phenylpropyl)hexanamide
CID 82848318
3-amino-N-[1-(2-chlorophenyl)propan-2-yl]-2,2-dimethylpropanamide
CID 81489482

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide?
The IUPAC name of 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide (CID 115426224) is 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide.
What is the SMILES notation for 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide?
The canonical SMILES for 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide is CC(C)(CN)C(=O)NC(c1ccccc1)C(C)(C)C.
What is the InChIKey of 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide?
The InChIKey is FJGRKCLNZUPYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-15(2,3)13(12-9-7-6-8-10-12)18-14(19)16(4,5)11-17/h6-10,13H,11,17H2,1-5H3,(H,18,19).
What are the key properties of 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide?
3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide has a molecular weight of 262.40 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,2-dimethyl-1-phenylpropyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 115426224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).