2-amino-3-phenyl-N-(3-propoxypropyl)propanamide

C15H24N2O2 — CID 82942033

IUPAC2-amino-3-phenyl-N-(3-propoxypropyl)propanamide
SMILESCCCOCCCNC(=O)C(N)Cc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-2-10-19-11-6-9-17-15(18)14(16)12-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12,16H2,1H3,(H,17,18)
InChIKeyIFPHZRXLGHQJAJ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.49
Rot. Bonds9

About 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide

2-amino-3-phenyl-N-(3-propoxypropyl)propanamide (PubChem CID 82942033) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide.

Molecular Properties

Compound Name2-amino-3-phenyl-N-(3-propoxypropyl)propanamide
PubChem CID82942033
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-amino-3-phenyl-N-(3-propoxypropyl)propanamide
SMILESCCCOCCCNC(=O)C(N)Cc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-2-10-19-11-6-9-17-15(18)14(16)12-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12,16H2,1H3,(H,17,18)
InChIKeyIFPHZRXLGHQJAJ-UHFFFAOYSA-N
XLogP1.49
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-amino-N-[3-(2-hydroxyethoxy)propyl]-3-phenylpropanamide
CID 106310662
(2R)-2-amino-N-[4-(2-methoxyethoxy)butyl]-3-phenylpropanamide
CID 103796209
2-amino-N-(3-methoxypropyl)-3-phenylpropanamide
CID 43153328
2-(aminomethyl)-3-phenyl-N-(3-propoxypropyl)propanamide
CID 82940849
2-amino-N-decyl-3-phenylpropanamide
CID 122423651
2-amino-N-(3-butoxypropyl)-3-(4-hydroxyphenyl)propanamide
CID 114350754
(2S)-2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-phenylpropanamide
CID 61275037
2-amino-N-(3-hydroxypropyl)-3-phenylpropanamide
CID 14308256
(2R)-2-amino-N-(5-methoxypentyl)-3-phenylpropanamide
CID 103796033
2-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]-3-phenylpropanamide
CID 106236678
(2R)-2-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]-3-phenylpropanamide
CID 106236520
2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
CID 53409094

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide?
The IUPAC name of 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide (CID 82942033) is 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide.
What is the SMILES notation for 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide?
The canonical SMILES for 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide is CCCOCCCNC(=O)C(N)Cc1ccccc1.
What is the InChIKey of 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide?
The InChIKey is IFPHZRXLGHQJAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-2-10-19-11-6-9-17-15(18)14(16)12-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12,16H2,1H3,(H,17,18).
What are the key properties of 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide?
2-amino-3-phenyl-N-(3-propoxypropyl)propanamide has a molecular weight of 264.37 g/mol, XLogP of 1.49, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-phenyl-N-(3-propoxypropyl)propanamide is sourced from PubChem (CID 82942033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).