N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide

C15H22N2O2 — CID 143986713

IUPACN-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide
SMILESCCCCC(=O)NC(Cc1ccccc1)C(=O)NC
InChIInChI=1S/C15H22N2O2/c1-3-4-10-14(18)17-13(15(19)16-2)11-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyDHSGIOQQBHVGES-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.65
Rot. Bonds7

About N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide

N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide (PubChem CID 143986713) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide.

Molecular Properties

Compound NameN-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide
PubChem CID143986713
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide
SMILESCCCCC(=O)NC(Cc1ccccc1)C(=O)NC
InChIInChI=1S/C15H22N2O2/c1-3-4-10-14(18)17-13(15(19)16-2)11-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyDHSGIOQQBHVGES-UHFFFAOYSA-N
XLogP1.65
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2S)-1-(dodecylamino)-1-oxo-3-phenylpropan-2-yl]dodecanamide
CID 12049932
N-[1-(benzylamino)-1-oxo-3-phenylpropan-2-yl]hexanamide
CID 42706052
N-[(2R)-4,4-dimethyl-3-oxo-1-phenylpentan-2-yl]pentanamide
CID 159234420
3-phenyl-2-(undecanoylamino)propanoic acid
CID 71318408
(2R)-2-(dodecanoylamino)-3-phenylpropanoic acid
CID 10936951
(2S)-2-(nonadecanoylamino)-3-phenylpropanoic acid
CID 171116992
2-(dodecanoylamino)-3-phenylpropanoic acid
CID 14509918
(2R)-2-[(2-aminoacetyl)amino]-N-methyl-3-phenylpropanamide
CID 11142613
N-[1-oxo-3-phenyl-1-(2-phenylethylamino)propan-2-yl]heptanamide
CID 42701600
CID 160842704
CID 160842704
N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]octadecanamide
CID 54545084
prop-2-enyl 2-(pentanoylamino)-3-phenylpropanoate
CID 67861490

Frequently Asked Questions

What is the IUPAC name of N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide?
The IUPAC name of N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide (CID 143986713) is N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide.
What is the SMILES notation for N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide?
The canonical SMILES for N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide is CCCCC(=O)NC(Cc1ccccc1)C(=O)NC.
What is the InChIKey of N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide?
The InChIKey is DHSGIOQQBHVGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-4-10-14(18)17-13(15(19)16-2)11-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide?
N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide has a molecular weight of 262.35 g/mol, XLogP of 1.65, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide is sourced from PubChem (CID 143986713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).