N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide

C15H24N2O — CID 106275795

IUPACN,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide
SMILESCNC(=O)C(C)(C)CNC(C)Cc1ccccc1
InChIInChI=1S/C15H24N2O/c1-12(10-13-8-6-5-7-9-13)17-11-15(2,3)14(18)16-4/h5-9,12,17H,10-11H2,1-4H3,(H,16,18)
InChIKeyFJAGPACAXTUGEQ-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.98
Rot. Bonds6

About N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide

N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide (PubChem CID 106275795) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide
PubChem CID106275795
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide
SMILESCNC(=O)C(C)(C)CNC(C)Cc1ccccc1
InChIInChI=1S/C15H24N2O/c1-12(10-13-8-6-5-7-9-13)17-11-15(2,3)14(18)16-4/h5-9,12,17H,10-11H2,1-4H3,(H,16,18)
InChIKeyFJAGPACAXTUGEQ-UHFFFAOYSA-N
XLogP1.98
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 65108155
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CID 115649433
acetic acid;N-ethyl-1-phenylpropan-2-amine
CID 22214099
2-amino-2-phenyl-N-(1-phenylpropan-2-yl)propanamide
CID 63011622
(1-phenylpropan-2-ylamino)methanol
CID 54463712
N,2,2-trimethyl-3-(1-thiophen-2-ylethylamino)propanamide
CID 104536070
2-[4-[2-[(2-hydroxy-2-phenylpropyl)amino]propyl]phenoxy]-N-methylacetamide
CID 57018327
N-methyl-2-(1-phenylpropan-2-ylamino)propanamide
CID 63010546
3-[1-(2-ethoxyphenyl)ethylamino]-N,2,2-trimethylpropanamide
CID 103917249
2,2-dimethyl-3-(1-thiophen-3-ylpropan-2-ylamino)propanoic acid
CID 79623332
1-phenyl-2-(1-phenylpropan-2-ylamino)ethanone;hydrochloride
CID 12910708
N-methyl-1-phenylpropan-2-amine
CID 118309477

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide?
The IUPAC name of N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide (CID 106275795) is N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide.
What is the SMILES notation for N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide?
The canonical SMILES for N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide is CNC(=O)C(C)(C)CNC(C)Cc1ccccc1.
What is the InChIKey of N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide?
The InChIKey is FJAGPACAXTUGEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12(10-13-8-6-5-7-9-13)17-11-15(2,3)14(18)16-4/h5-9,12,17H,10-11H2,1-4H3,(H,16,18).
What are the key properties of N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide?
N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide has a molecular weight of 248.37 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-(1-phenylpropan-2-ylamino)propanamide is sourced from PubChem (CID 106275795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).