N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide

C15H24N2O2 — CID 119608690

IUPACN-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)NC(C)(CN)C(C)C
InChIInChI=1S/C15H24N2O2/c1-11(2)15(4,10-16)17-14(18)12(3)19-13-8-6-5-7-9-13/h5-9,11-12H,10,16H2,1-4H3,(H,17,18)
InChIKeyIQGAZXSTEQTINO-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.94
Rot. Bonds6

About N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide

N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide (PubChem CID 119608690) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide.

Molecular Properties

Compound NameN-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide
PubChem CID119608690
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)NC(C)(CN)C(C)C
InChIInChI=1S/C15H24N2O2/c1-11(2)15(4,10-16)17-14(18)12(3)19-13-8-6-5-7-9-13/h5-9,11-12H,10,16H2,1-4H3,(H,17,18)
InChIKeyIQGAZXSTEQTINO-UHFFFAOYSA-N
XLogP1.94
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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-2,3-dimethylbutan-2-yl)-2-(3-propan-2-ylphenoxy)propanamide;hydrochloride
CID 119606053
2-methyl-2-(2-phenoxypropanoylamino)propanoic acid
CID 61262074
N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxyacetamide;hydrochloride
CID 119605895
N-(1-amino-2-methylpropan-2-yl)-2-(3-chlorophenoxy)propanamide
CID 63193676
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(2-bromo-4-methylphenoxy)propanamide
CID 119606088
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(2,4-dichlorophenoxy)propanamide
CID 119606020
N-(2-amino-2-methylpropyl)-2-phenoxypropanamide;hydrochloride
CID 119630231
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methoxyphenyl)propanamide
CID 119606161
(2R)-2-phenoxy-N-[2-[[(2R)-2-phenoxypropanoyl]amino]ethyl]propanamide
CID 7039405
N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenylacetamide;hydrochloride
CID 119608428
(2S)-2-phenoxy-N-[9-[[(2S)-2-phenoxypropanoyl]amino]nonyl]propanamide
CID 28839964
N-methyl-2-phenoxypropanamide
CID 4626974

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide?
The IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide (CID 119608690) is N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide.
What is the SMILES notation for N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide?
The canonical SMILES for N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide is CC(Oc1ccccc1)C(=O)NC(C)(CN)C(C)C.
What is the InChIKey of N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide?
The InChIKey is IQGAZXSTEQTINO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)15(4,10-16)17-14(18)12(3)19-13-8-6-5-7-9-13/h5-9,11-12H,10,16H2,1-4H3,(H,17,18).
What are the key properties of N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide?
N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide has a molecular weight of 264.37 g/mol, XLogP of 1.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxypropanamide is sourced from PubChem (CID 119608690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).