2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide

C20H26N2O2 — CID 120667859

IUPAC2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide
SMILESCc1ccc(C(N)C(=O)NCc2cccc(OCC(C)C)c2)cc1
InChIInChI=1S/C20H26N2O2/c1-14(2)13-24-18-6-4-5-16(11-18)12-22-20(23)19(21)17-9-7-15(3)8-10-17/h4-11,14,19H,12-13,21H2,1-3H3,(H,22,23)
InChIKeyKPDIWMZSXHPMTL-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.35
Rot. Bonds7

About 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide

2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide (PubChem CID 120667859) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide
PubChem CID120667859
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide
SMILESCc1ccc(C(N)C(=O)NCc2cccc(OCC(C)C)c2)cc1
InChIInChI=1S/C20H26N2O2/c1-14(2)13-24-18-6-4-5-16(11-18)12-22-20(23)19(21)17-9-7-15(3)8-10-17/h4-11,14,19H,12-13,21H2,1-3H3,(H,22,23)
InChIKeyKPDIWMZSXHPMTL-UHFFFAOYSA-N
XLogP3.35
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(3-methoxyphenyl)methyl]-2-(4-methylphenyl)acetamide
CID 106151129
2-amino-2-(4-methylphenyl)-N-[3-(2-methylpropoxy)phenyl]acetamide;hydrochloride
CID 120667184
2-amino-N-[[3-(2-methylpropoxy)phenyl]methyl]pentanamide
CID 119304653
2-amino-2-(4-methylphenyl)-N-[[2-(2-methylpropoxy)phenyl]methyl]acetamide
CID 120667659
2-amino-N-[1-(3-methylphenoxy)propan-2-yl]-2-(4-methylphenyl)acetamide
CID 120667713
2-chloro-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide
CID 166403692
2-amino-N-[[3-(2-methylpropoxy)phenyl]methyl]-2-(oxan-4-yl)acetamide
CID 120789950
2-amino-N-[[3-(2-methylpropoxy)phenyl]methyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120789949
tert-butyl N-[[3-(2-methylpropoxy)phenyl]methyl]carbamate
CID 138586671
3-[[[2-amino-2-(4-methylphenyl)acetyl]amino]methyl]-N-propylbenzamide;hydrochloride
CID 120667273
2-amino-N-[[3-(azepan-1-ylmethyl)phenyl]methyl]-2-(4-methylphenyl)acetamide
CID 120669979
3-amino-N-[[3-(2-methylpropoxy)phenyl]methyl]benzamide;hydrochloride
CID 119751160

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide?
The IUPAC name of 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide (CID 120667859) is 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide.
What is the SMILES notation for 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide?
The canonical SMILES for 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide is Cc1ccc(C(N)C(=O)NCc2cccc(OCC(C)C)c2)cc1.
What is the InChIKey of 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide?
The InChIKey is KPDIWMZSXHPMTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-14(2)13-24-18-6-4-5-16(11-18)12-22-20(23)19(21)17-9-7-15(3)8-10-17/h4-11,14,19H,12-13,21H2,1-3H3,(H,22,23).
What are the key properties of 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide?
2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide has a molecular weight of 326.44 g/mol, XLogP of 3.35, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(4-methylphenyl)-N-[[3-(2-methylpropoxy)phenyl]methyl]acetamide is sourced from PubChem (CID 120667859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).