2-amino-2-methyl-N-(5-phenylpentyl)propanamide

C15H24N2O — CID 119317062

IUPAC2-amino-2-methyl-N-(5-phenylpentyl)propanamide
SMILESCC(C)(N)C(=O)NCCCCCc1ccccc1
InChIInChI=1S/C15H24N2O/c1-15(2,16)14(18)17-12-8-4-7-11-13-9-5-3-6-10-13/h3,5-6,9-10H,4,7-8,11-12,16H2,1-2H3,(H,17,18)
InChIKeyQFCHJNFSWKEGKI-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.25
Rot. Bonds7

About 2-amino-2-methyl-N-(5-phenylpentyl)propanamide

2-amino-2-methyl-N-(5-phenylpentyl)propanamide (PubChem CID 119317062) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(5-phenylpentyl)propanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(5-phenylpentyl)propanamide
PubChem CID119317062
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-amino-2-methyl-N-(5-phenylpentyl)propanamide
SMILESCC(C)(N)C(=O)NCCCCCc1ccccc1
InChIInChI=1S/C15H24N2O/c1-15(2,16)14(18)17-12-8-4-7-11-13-9-5-3-6-10-13/h3,5-6,9-10H,4,7-8,11-12,16H2,1-2H3,(H,17,18)
InChIKeyQFCHJNFSWKEGKI-UHFFFAOYSA-N
XLogP2.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(5-phenylpentyl)propanamide?
The IUPAC name of 2-amino-2-methyl-N-(5-phenylpentyl)propanamide (CID 119317062) is 2-amino-2-methyl-N-(5-phenylpentyl)propanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(5-phenylpentyl)propanamide?
The canonical SMILES for 2-amino-2-methyl-N-(5-phenylpentyl)propanamide is CC(C)(N)C(=O)NCCCCCc1ccccc1.
What is the InChIKey of 2-amino-2-methyl-N-(5-phenylpentyl)propanamide?
The InChIKey is QFCHJNFSWKEGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-15(2,16)14(18)17-12-8-4-7-11-13-9-5-3-6-10-13/h3,5-6,9-10H,4,7-8,11-12,16H2,1-2H3,(H,17,18).
What are the key properties of 2-amino-2-methyl-N-(5-phenylpentyl)propanamide?
2-amino-2-methyl-N-(5-phenylpentyl)propanamide has a molecular weight of 248.37 g/mol, XLogP of 2.25, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(5-phenylpentyl)propanamide is sourced from PubChem (CID 119317062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).