3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide

C20H26N2O — CID 119724309

IUPAC3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide
SMILESCC(C(=O)NCC(C)(C)c1ccccc1)C(N)c1ccccc1
InChIInChI=1S/C20H26N2O/c1-15(18(21)16-10-6-4-7-11-16)19(23)22-14-20(2,3)17-12-8-5-9-13-17/h4-13,15,18H,14,21H2,1-3H3,(H,22,23)
InChIKeyCKHMGPDOHSPNDJ-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.42
Rot. Bonds6

About 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide

3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide (PubChem CID 119724309) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide
PubChem CID119724309
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide
SMILESCC(C(=O)NCC(C)(C)c1ccccc1)C(N)c1ccccc1
InChIInChI=1S/C20H26N2O/c1-15(18(21)16-10-6-4-7-11-16)19(23)22-14-20(2,3)17-12-8-5-9-13-17/h4-13,15,18H,14,21H2,1-3H3,(H,22,23)
InChIKeyCKHMGPDOHSPNDJ-UHFFFAOYSA-N
XLogP3.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(2-methyl-2-phenylpropyl)-2-phenylacetamide
CID 104897542
3-amino-2-methyl-N-[2-methyl-2-(1-phenylethylamino)propyl]-3-phenylpropanamide;dihydrochloride
CID 119877886
3-amino-2-methyl-3-phenyl-N-(2-phenylpropan-2-yl)propanamide;hydrochloride
CID 119709318
3-amino-N-(2-methyl-2-phenylpropyl)-2-phenylpropanamide;hydrochloride
CID 119724299
2-amino-N-[2-(4-bromophenyl)-2-methylpropyl]-2-phenylacetamide
CID 119295146
3-amino-N-(5,5-dimethylhexyl)-2-methyl-3-phenylpropanamide
CID 119775743
3-amino-N-(2-hydroxypropyl)-2-methyl-3-phenylpropanamide
CID 80551917
(2S)-2-amino-N-(2-methyl-2-phenylpropyl)pentanamide
CID 93398886
3-amino-N-[2-(dimethylamino)propyl]-2-methyl-3-phenylpropanamide;dihydrochloride
CID 119861809
3-amino-2-methyl-3-phenyl-N-prop-2-enylpropanamide
CID 80551795
3-amino-2-methyl-N-(2-methylbutan-2-yl)-3-phenylpropanamide
CID 80551789
4-[(3-amino-2-methyl-3-phenylpropanoyl)amino]butanoic acid
CID 80552213

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide?
The IUPAC name of 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide (CID 119724309) is 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide.
What is the SMILES notation for 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide?
The canonical SMILES for 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide is CC(C(=O)NCC(C)(C)c1ccccc1)C(N)c1ccccc1.
What is the InChIKey of 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide?
The InChIKey is CKHMGPDOHSPNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-15(18(21)16-10-6-4-7-11-16)19(23)22-14-20(2,3)17-12-8-5-9-13-17/h4-13,15,18H,14,21H2,1-3H3,(H,22,23).
What are the key properties of 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide?
3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide has a molecular weight of 310.44 g/mol, XLogP of 3.42, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-N-(2-methyl-2-phenylpropyl)-3-phenylpropanamide is sourced from PubChem (CID 119724309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).