N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide

C14H22N2O2 — CID 110832913

IUPACN-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide
SMILESCOc1cc(C)ccc1CC(=O)NC(C)(C)CN
InChIInChI=1S/C14H22N2O2/c1-10-5-6-11(12(7-10)18-4)8-13(17)16-14(2,3)9-15/h5-7H,8-9,15H2,1-4H3,(H,16,17)
InChIKeyUTFCYAFOQGESDT-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.40
Rot. Bonds5

About N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide

N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide (PubChem CID 110832913) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide
PubChem CID110832913
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide
SMILESCOc1cc(C)ccc1CC(=O)NC(C)(C)CN
InChIInChI=1S/C14H22N2O2/c1-10-5-6-11(12(7-10)18-4)8-13(17)16-14(2,3)9-15/h5-7H,8-9,15H2,1-4H3,(H,16,17)
InChIKeyUTFCYAFOQGESDT-UHFFFAOYSA-N
XLogP1.40
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide (CID 110832913) is N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide is COc1cc(C)ccc1CC(=O)NC(C)(C)CN.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide?
The InChIKey is UTFCYAFOQGESDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10-5-6-11(12(7-10)18-4)8-13(17)16-14(2,3)9-15/h5-7H,8-9,15H2,1-4H3,(H,16,17).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide?
N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide has a molecular weight of 250.34 g/mol, XLogP of 1.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-4-methylphenyl)acetamide is sourced from PubChem (CID 110832913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).