4-amino-2-propan-2-yloxybenzamide

C10H14N2O2 — CID 53495725

IUPAC4-amino-2-propan-2-yloxybenzamide
SMILESCC(C)Oc1cc(N)ccc1C(N)=O
InChIInChI=1S/C10H14N2O2/c1-6(2)14-9-5-7(11)3-4-8(9)10(12)13/h3-6H,11H2,1-2H3,(H2,12,13)
InChIKeyCPJGYRKDUVSLEY-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.15
Rot. Bonds3

About 4-amino-2-propan-2-yloxybenzamide

4-amino-2-propan-2-yloxybenzamide (PubChem CID 53495725) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 4-amino-2-propan-2-yloxybenzamide.

Molecular Properties

Compound Name4-amino-2-propan-2-yloxybenzamide
PubChem CID53495725
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name4-amino-2-propan-2-yloxybenzamide
SMILESCC(C)Oc1cc(N)ccc1C(N)=O
InChIInChI=1S/C10H14N2O2/c1-6(2)14-9-5-7(11)3-4-8(9)10(12)13/h3-6H,11H2,1-2H3,(H2,12,13)
InChIKeyCPJGYRKDUVSLEY-UHFFFAOYSA-N
XLogP1.15
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.15
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-amino-2-(2-hydroxypropoxy)benzamide
CID 106955593
1-(5-amino-2-propan-2-yloxyphenyl)ethanone
CID 70224609
4-[[(Z)-1-(4-amino-2-propan-2-yloxyphenyl)-5-methyl-1-oxohex-2-en-3-yl]amino]-2-propan-2-yloxybenzamide
CID 53496264
4-methoxy-3-propan-2-yloxyaniline
CID 16785912
2-amino-3-chloro-4-propan-2-yloxybenzamide
CID 67278409
methyl 4-amino-2-(1-methoxy-1-oxopropan-2-yl)oxybenzoate
CID 106955156
4-amino-2-[3-oxo-3-(propan-2-ylamino)propoxy]benzamide
CID 106955525
4-amino-2-(4-bromo-2-propan-2-ylphenoxy)benzamide
CID 115401530
5-bromo-2-propan-2-yloxybenzamide
CID 17052192
4-amino-2-(ethoxymethoxy)benzamide
CID 106955437
5-fluoro-4-methyl-2-propan-2-yloxybenzamide
CID 59113922
4-amino-2-[2-(1-methoxypropan-2-ylamino)-2-oxoethoxy]benzamide
CID 106955522

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-propan-2-yloxybenzamide?
The IUPAC name of 4-amino-2-propan-2-yloxybenzamide (CID 53495725) is 4-amino-2-propan-2-yloxybenzamide.
What is the SMILES notation for 4-amino-2-propan-2-yloxybenzamide?
The canonical SMILES for 4-amino-2-propan-2-yloxybenzamide is CC(C)Oc1cc(N)ccc1C(N)=O.
What is the InChIKey of 4-amino-2-propan-2-yloxybenzamide?
The InChIKey is CPJGYRKDUVSLEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-6(2)14-9-5-7(11)3-4-8(9)10(12)13/h3-6H,11H2,1-2H3,(H2,12,13).
What are the key properties of 4-amino-2-propan-2-yloxybenzamide?
4-amino-2-propan-2-yloxybenzamide has a molecular weight of 194.23 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-propan-2-yloxybenzamide is sourced from PubChem (CID 53495725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).