N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide

C14H22N2O3 — CID 106152212

IUPACN-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide
SMILESCOCC(CCN)NC(=O)Cc1ccc(OC)cc1
InChIInChI=1S/C14H22N2O3/c1-18-10-12(7-8-15)16-14(17)9-11-3-5-13(19-2)6-4-11/h3-6,12H,7-10,15H2,1-2H3,(H,16,17)
InChIKeyQFIFSZQTUOQJOF-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.72
Rot. Bonds8

About N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide

N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide (PubChem CID 106152212) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide
PubChem CID106152212
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide
SMILESCOCC(CCN)NC(=O)Cc1ccc(OC)cc1
InChIInChI=1S/C14H22N2O3/c1-18-10-12(7-8-15)16-14(17)9-11-3-5-13(19-2)6-4-11/h3-6,12H,7-10,15H2,1-2H3,(H,16,17)
InChIKeyQFIFSZQTUOQJOF-UHFFFAOYSA-N
XLogP0.72
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-amino-1-methoxybutan-2-yl)-2-(3-methylphenyl)acetamide
CID 106152342
N-(4-amino-1-methoxybutan-2-yl)-2-(2-fluorophenyl)acetamide
CID 106152498
N-(4-amino-1-methoxybutan-2-yl)-3-(4-methylphenyl)propanamide
CID 106152335
N-(1,3-dihydroxypropan-2-yl)-2-(4-methoxyphenyl)acetamide
CID 65315308
N-(4-hydroxy-1-methoxybutan-2-yl)-2-(4-methylphenyl)acetamide
CID 103799183
N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide
CID 104872813
N-(3-amino-4-methoxybutyl)-2-(4-methoxyphenyl)acetamide
CID 106243082
N-(1-amino-3-methoxypropan-2-yl)-2-(3,4-difluorophenyl)acetamide
CID 106180111
2-(4-methoxyphenyl)-N-propan-2-ylacetamide
CID 813075
N-(4-chloro-1-methoxybutan-2-yl)-2-phenylacetamide
CID 106155031
N-(1-bromo-3-methoxypropan-2-yl)-3-(4-methoxyphenyl)propanamide
CID 114155384
N-[(2S)-1-methoxy-3-(4-methoxyphenyl)propan-2-yl]acetamide
CID 71195446

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide (CID 106152212) is N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide is COCC(CCN)NC(=O)Cc1ccc(OC)cc1.
What is the InChIKey of N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide?
The InChIKey is QFIFSZQTUOQJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-18-10-12(7-8-15)16-14(17)9-11-3-5-13(19-2)6-4-11/h3-6,12H,7-10,15H2,1-2H3,(H,16,17).
What are the key properties of N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide?
N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide has a molecular weight of 266.34 g/mol, XLogP of 0.72, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 106152212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).