2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide

C15H24N2O — CID 106328752

IUPAC2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide
SMILESCCC(C)(CC)NC(=O)C(N)Cc1ccccc1
InChIInChI=1S/C15H24N2O/c1-4-15(3,5-2)17-14(18)13(16)11-12-9-7-6-8-10-12/h6-10,13H,4-5,11,16H2,1-3H3,(H,17,18)
InChIKeyRVIHIIRKIPAKHG-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.25
Rot. Bonds6

About 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide

2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide (PubChem CID 106328752) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide
PubChem CID106328752
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide
SMILESCCC(C)(CC)NC(=O)C(N)Cc1ccccc1
InChIInChI=1S/C15H24N2O/c1-4-15(3,5-2)17-14(18)13(16)11-12-9-7-6-8-10-12/h6-10,13H,4-5,11,16H2,1-3H3,(H,17,18)
InChIKeyRVIHIIRKIPAKHG-UHFFFAOYSA-N
XLogP2.25
TPSA55.12 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 ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(1-hydroxy-3-methylpentan-3-yl)-3-phenylpropanamide
CID 106176498
(2R)-2-amino-N-(3-ethylpentan-3-yl)-3-phenylpropanamide
CID 79004352
(2S)-2-amino-N-[(2S)-2-amino-3-phenylpropanoyl]-3-phenylpropanamide
CID 21116073
2-amino-N-ethoxy-3-phenylpropanamide
CID 64974799
2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
CID 53409094
(2S)-2-amino-N-ethoxy-3-phenylpropanamide
CID 64974630
(2S)-2-amino-N-(3,3-dimethylbutyl)-3-phenylpropanamide
CID 83306119
2-[(2-amino-3-phenylpropanoyl)amino]-3,3-dimethylbutanoic acid
CID 61162163
(2S)-2-amino-N-(3,3-dimethylbutyl)-3-phenylpropanamide;hydrochloride
CID 119279534
2-(3-methylpentan-3-ylcarbamoylamino)-3-phenylpropanoic acid
CID 106330586
2-amino-N-ethyl-3-phenylpropanamide;2,2,2-trifluoroacetic acid
CID 70927054
2-amino-3-phenyl-N-propan-2-ylpropanamide
CID 15926064

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide?
The IUPAC name of 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide (CID 106328752) is 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide is CCC(C)(CC)NC(=O)C(N)Cc1ccccc1.
What is the InChIKey of 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide?
The InChIKey is RVIHIIRKIPAKHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-15(3,5-2)17-14(18)13(16)11-12-9-7-6-8-10-12/h6-10,13H,4-5,11,16H2,1-3H3,(H,17,18).
What are the key properties of 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide?
2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide has a molecular weight of 248.37 g/mol, XLogP of 2.25, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-methylpentan-3-yl)-3-phenylpropanamide is sourced from PubChem (CID 106328752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).