N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide

C15H24N2O2 — CID 119588476

IUPACN-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide
SMILESCC(C)CC(CN)NC(=O)C(C)Oc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-11(2)9-13(10-16)17-15(18)12(3)19-14-7-5-4-6-8-14/h4-8,11-13H,9-10,16H2,1-3H3,(H,17,18)
InChIKeyOLXRBQKHSYBNSL-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.94
Rot. Bonds7

About N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide

N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide (PubChem CID 119588476) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide
PubChem CID119588476
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide
SMILESCC(C)CC(CN)NC(=O)C(C)Oc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-11(2)9-13(10-16)17-15(18)12(3)19-14-7-5-4-6-8-14/h4-8,11-13H,9-10,16H2,1-3H3,(H,17,18)
InChIKeyOLXRBQKHSYBNSL-UHFFFAOYSA-N
XLogP1.94
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-4-methylpentan-2-yl)-2-pyridin-3-yloxypropanamide;dihydrochloride
CID 119587934
N-(1-amino-4-methylpentan-2-yl)-2-(3-chlorophenoxy)propanamide;hydrochloride
CID 119586806
(2R)-N-[(1R)-3-methyl-1-phenylbutyl]-2-phenoxypropanamide
CID 41198910
N-(1-amino-4-methylpentan-2-yl)-2-(2-chlorophenoxy)propanamide;hydrochloride
CID 119586798
2-(2-phenoxypropanoylamino)propanoic acid
CID 43092023
(2R)-2-phenoxy-N-[2-[[(2R)-2-phenoxypropanoyl]amino]ethyl]propanamide
CID 7039405
N-[(2R)-1-hydroxybutan-2-yl]-2-phenoxypropanamide
CID 103920159
2-(4-bromophenoxy)-N-(1-hydroxy-4-methylpentan-2-yl)propanamide
CID 61247071
2-(3-fluorophenoxy)-N-(1-hydroxy-4-methylpentan-2-yl)propanamide
CID 61246472
(2S)-2-(4-fluorophenoxy)-N-[(1R)-3-methyl-1-phenylbutyl]propanamide
CID 94013029
N-(2-methylpropoxy)-2-phenoxypropanamide
CID 113304383
(2S)-2-phenoxy-N-[9-[[(2S)-2-phenoxypropanoyl]amino]nonyl]propanamide
CID 28839964

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide?
The IUPAC name of N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide (CID 119588476) is N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide.
What is the SMILES notation for N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide?
The canonical SMILES for N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide is CC(C)CC(CN)NC(=O)C(C)Oc1ccccc1.
What is the InChIKey of N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide?
The InChIKey is OLXRBQKHSYBNSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)9-13(10-16)17-15(18)12(3)19-14-7-5-4-6-8-14/h4-8,11-13H,9-10,16H2,1-3H3,(H,17,18).
What are the key properties of N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide?
N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide has a molecular weight of 264.37 g/mol, XLogP of 1.94, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-2-yl)-2-phenoxypropanamide is sourced from PubChem (CID 119588476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).