3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide

C15H22N2O2 — CID 62878363

IUPAC3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide
SMILESNCC(C(=O)NCCC1CCCO1)c1ccccc1
InChIInChI=1S/C15H22N2O2/c16-11-14(12-5-2-1-3-6-12)15(18)17-9-8-13-7-4-10-19-13/h1-3,5-6,13-14H,4,7-11,16H2,(H,17,18)
InChIKeySBZHBZDETWBVBD-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.41
Rot. Bonds6

About 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide

3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide (PubChem CID 62878363) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide
PubChem CID62878363
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide
SMILESNCC(C(=O)NCCC1CCCO1)c1ccccc1
InChIInChI=1S/C15H22N2O2/c16-11-14(12-5-2-1-3-6-12)15(18)17-9-8-13-7-4-10-19-13/h1-3,5-6,13-14H,4,7-11,16H2,(H,17,18)
InChIKeySBZHBZDETWBVBD-UHFFFAOYSA-N
XLogP1.41
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-5-(oxolan-2-yl)-2-phenylpentan-3-one
CID 116567022
methyl 3-[2-(oxolan-2-yl)ethylamino]-2-phenylpropanoate
CID 64567904
(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]-4-phenylbutanamide
CID 104984102
N-[2-[(3-amino-2-phenylpropanoyl)amino]ethyl]cyclopropanecarboxamide
CID 115738013
(1S)-N-[2-(oxolan-2-yl)ethyl]-1-phenylethanamine
CID 65163698
2-amino-N-[2-(oxolan-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 115286809
3-amino-N-methyl-N-(oxan-2-ylmethyl)-2-phenylpropanamide
CID 62876627
N-(oxolan-2-ylmethyl)-2-phenyl-3-pyridin-4-ylpropanamide
CID 110407872
3-amino-N-(2-cyclopentyloxyethyl)-2-phenylpropanamide;hydrochloride
CID 119737692
3-[(2S)-oxolan-2-yl]-N-[(3R)-3-phenylbutyl]propanamide
CID 94821729
(3S)-3-amino-4-oxo-4-[2-(oxolan-2-yl)ethylamino]butanoic acid
CID 67894474
3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide
CID 64566065

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide?
The IUPAC name of 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide (CID 62878363) is 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide is NCC(C(=O)NCCC1CCCO1)c1ccccc1.
What is the InChIKey of 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide?
The InChIKey is SBZHBZDETWBVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c16-11-14(12-5-2-1-3-6-12)15(18)17-9-8-13-7-4-10-19-13/h1-3,5-6,13-14H,4,7-11,16H2,(H,17,18).
What are the key properties of 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide?
3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide has a molecular weight of 262.35 g/mol, XLogP of 1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide is sourced from PubChem (CID 62878363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).