N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide

C20H25NO2 — CID 118609735

IUPACN-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide
SMILESCCC(=O)NCC(C)(C)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C20H25NO2/c1-4-19(22)21-15-20(2,3)17-11-8-12-18(13-17)23-14-16-9-6-5-7-10-16/h5-13H,4,14-15H2,1-3H3,(H,21,22)
InChIKeyBPHYKFFPRWFHGG-UHFFFAOYSA-N
MW311.42 g/mol
LogP4.07
Rot. Bonds7

About N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide

N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide (PubChem CID 118609735) has the molecular formula C20H25NO2 and a molecular weight of 311.42 g/mol. Its IUPAC name is N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide.

Molecular Properties

Compound NameN-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide
PubChem CID118609735
Molecular FormulaC20H25NO2
Molecular Weight311.42 g/mol
Exact Mass311.19
IUPAC NameN-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide
SMILESCCC(=O)NCC(C)(C)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C20H25NO2/c1-4-19(22)21-15-20(2,3)17-11-8-12-18(13-17)23-14-16-9-6-5-7-10-16/h5-13H,4,14-15H2,1-3H3,(H,21,22)
InChIKeyBPHYKFFPRWFHGG-UHFFFAOYSA-N
XLogP4.07
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.42
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-phenylmethoxyphenyl)propan-2-ol
CID 13368032
(2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid
CID 7345316
2-(3-phenylmethoxyphenyl)ethanamine;N-[2-(3-phenylmethoxyphenyl)ethyl]propanamide
CID 159272620
1-(2-methylnonan-2-yl)-3-phenylmethoxybenzene
CID 141065806
benzyl N-[2-[3-(aminomethyl)phenyl]-2-methylpropyl]carbamate
CID 90916438
N-ethyl-2-(3-phenylmethoxyanilino)acetamide
CID 54826259
N-[4-[[2-(3-phenylmethoxyanilino)acetyl]amino]phenyl]propanamide
CID 54826536
methyl (2R)-2,4-dimethyl-2-(3-phenylmethoxyphenyl)pent-4-enoate
CID 129390639
1-(2-methyl-1-prop-2-enoxypropan-2-yl)-3-phenylmethoxybenzene
CID 59204436
ethyl 3-[(2-methyl-2-phenylpropyl)amino]-3-oxopropanoate
CID 115138677
6-methyl-6-(3-phenylmethoxyphenyl)hepta-2,4-dienoic acid
CID 72530435
N,N-dimethyl-3-phenylmethoxybenzamide
CID 8778645

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide?
The IUPAC name of N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide (CID 118609735) is N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide.
What is the SMILES notation for N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide?
The canonical SMILES for N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide is CCC(=O)NCC(C)(C)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide?
The InChIKey is BPHYKFFPRWFHGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-4-19(22)21-15-20(2,3)17-11-8-12-18(13-17)23-14-16-9-6-5-7-10-16/h5-13H,4,14-15H2,1-3H3,(H,21,22).
What are the key properties of N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide?
N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide has a molecular weight of 311.42 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide is sourced from PubChem (CID 118609735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).