3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide

C15H24N2O2 — CID 54863187

IUPAC3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide
SMILESCOc1cc(C)ccc1NC(=O)CCNC(C)(C)C
InChIInChI=1S/C15H24N2O2/c1-11-6-7-12(13(10-11)19-5)17-14(18)8-9-16-15(2,3)4/h6-7,10,16H,8-9H2,1-5H3,(H,17,18)
InChIKeyFYTGMFXHXCSNCI-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.72
Rot. Bonds5

About 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide

3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide (PubChem CID 54863187) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide.

Molecular Properties

Compound Name3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide
PubChem CID54863187
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide
SMILESCOc1cc(C)ccc1NC(=O)CCNC(C)(C)C
InChIInChI=1S/C15H24N2O2/c1-11-6-7-12(13(10-11)19-5)17-14(18)8-9-16-15(2,3)4/h6-7,10,16H,8-9H2,1-5H3,(H,17,18)
InChIKeyFYTGMFXHXCSNCI-UHFFFAOYSA-N
XLogP2.72
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(tert-butylamino)-N-(4-chloro-2,5-dimethoxyphenyl)propanamide
CID 60850759
N-(2-methoxy-4-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604669
3-(tert-butylamino)-N-(5-chloro-2-methoxyphenyl)propanamide
CID 54928228
N-(2-methoxy-4-methylphenyl)-2-(methylamino)acetamide;hydrochloride
CID 119740565
2-(2-methoxyethylamino)-N-(2-methoxy-4-methylphenyl)acetamide
CID 79282634
2,2,2-trichloro-N-(2-methoxy-4-methylphenyl)acetamide
CID 3499953
N-(2-bromo-4-methylphenyl)-3-(2,4-dimethoxyanilino)propanamide
CID 109040499
3-(tert-butylamino)-N-(3,4,5-trimethoxyphenyl)propanamide
CID 109031433
N-(2-methoxy-4-methylphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958038
N-(2-methoxy-5-methylphenyl)-3-(4-methylanilino)propanamide
CID 109034471
2-[2-(2-methoxy-4-methylanilino)-2-oxoethoxy]acetic acid
CID 61328811
3-amino-N-(2-methoxy-4-methylphenyl)butanamide
CID 60928646

Frequently Asked Questions

What is the IUPAC name of 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide?
The IUPAC name of 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide (CID 54863187) is 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide.
What is the SMILES notation for 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide?
The canonical SMILES for 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide is COc1cc(C)ccc1NC(=O)CCNC(C)(C)C.
What is the InChIKey of 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide?
The InChIKey is FYTGMFXHXCSNCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11-6-7-12(13(10-11)19-5)17-14(18)8-9-16-15(2,3)4/h6-7,10,16H,8-9H2,1-5H3,(H,17,18).
What are the key properties of 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide?
3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide has a molecular weight of 264.37 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(tert-butylamino)-N-(2-methoxy-4-methylphenyl)propanamide is sourced from PubChem (CID 54863187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).