4-amino-N-(4-propan-2-yloxyphenyl)benzamide

C16H18N2O2 — CID 28722589

IUPAC4-amino-N-(4-propan-2-yloxyphenyl)benzamide
SMILESCC(C)Oc1ccc(NC(=O)c2ccc(N)cc2)cc1
InChIInChI=1S/C16H18N2O2/c1-11(2)20-15-9-7-14(8-10-15)18-16(19)12-3-5-13(17)6-4-12/h3-11H,17H2,1-2H3,(H,18,19)
InChIKeyZBFKTZGAGWEWFY-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.31
Rot. Bonds4

About 4-amino-N-(4-propan-2-yloxyphenyl)benzamide

4-amino-N-(4-propan-2-yloxyphenyl)benzamide (PubChem CID 28722589) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 4-amino-N-(4-propan-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-amino-N-(4-propan-2-yloxyphenyl)benzamide
PubChem CID28722589
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name4-amino-N-(4-propan-2-yloxyphenyl)benzamide
SMILESCC(C)Oc1ccc(NC(=O)c2ccc(N)cc2)cc1
InChIInChI=1S/C16H18N2O2/c1-11(2)20-15-9-7-14(8-10-15)18-16(19)12-3-5-13(17)6-4-12/h3-11H,17H2,1-2H3,(H,18,19)
InChIKeyZBFKTZGAGWEWFY-UHFFFAOYSA-N
XLogP3.31
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(methylamino)-N-(4-propan-2-yloxyphenyl)benzamide
CID 62166478
N-(4-aminophenyl)-4-(2-methylpropanoyl)benzamide;2-methylpropane
CID 144512975
3-amino-4-methoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 39423304
4-N,4-N-diethyl-1-N-(4-propan-2-yloxyphenyl)benzene-1,4-dicarboxamide
CID 109048416
4-amino-N-(4-aminophenyl)benzamide;ethanamine
CID 19078068
4-propan-2-yloxy-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154760
N-naphthalen-2-yl-4-propan-2-yloxybenzamide
CID 823400
N-[4-(2-ethoxyethoxy)phenyl]-4-propan-2-yloxybenzamide
CID 17130636
4-amino-N-(3-chloro-4-propan-2-yloxyphenyl)benzamide
CID 43712010
4-pentoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 17340246
4-(2-methylprop-2-enoxy)-N-(4-propan-2-yloxyphenyl)benzamide
CID 17123815
N-(3,5-dibromo-4-hydroxyphenyl)-4-propan-2-yloxybenzamide
CID 5119029

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-propan-2-yloxyphenyl)benzamide?
The IUPAC name of 4-amino-N-(4-propan-2-yloxyphenyl)benzamide (CID 28722589) is 4-amino-N-(4-propan-2-yloxyphenyl)benzamide.
What is the SMILES notation for 4-amino-N-(4-propan-2-yloxyphenyl)benzamide?
The canonical SMILES for 4-amino-N-(4-propan-2-yloxyphenyl)benzamide is CC(C)Oc1ccc(NC(=O)c2ccc(N)cc2)cc1.
What is the InChIKey of 4-amino-N-(4-propan-2-yloxyphenyl)benzamide?
The InChIKey is ZBFKTZGAGWEWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11(2)20-15-9-7-14(8-10-15)18-16(19)12-3-5-13(17)6-4-12/h3-11H,17H2,1-2H3,(H,18,19).
What are the key properties of 4-amino-N-(4-propan-2-yloxyphenyl)benzamide?
4-amino-N-(4-propan-2-yloxyphenyl)benzamide has a molecular weight of 270.33 g/mol, XLogP of 3.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-propan-2-yloxyphenyl)benzamide is sourced from PubChem (CID 28722589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).